trans-4-[(1R)-1-Aminoethyl]-N-(4-pyridinyl)cyclohexanecarboxamide dihydrochloride

Basic Information

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CAS Number

129830-38-2

Molecular Formula

C14H23Cl2N3O

Molecular Weight

320.26 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

258 ºC

Solubility

H2O: soluble14mg/mL

SMILES

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C[C@@H](N)[C@H]1CC[C@@H](CC1)C(=O)Nc2ccncc2.Cl.Cl

InChI

InChI=1S/C14H21N3O.2ClH/c1-10(15)11-2-4-12(5-3-11)14(18)17-13-6-8-16-9-7-13;;/h6-12H,2-5,15H2,1H3,(H,16,17,18);2*1H/t10-,11-,12-;;/m1../s1

InChIKey

IDDDVXIUIXWAGJ-LJDSMOQUSA-N

LogP

3.0173000000000014

Topological Polar Surface Area

68.01 Å²

Hydrogen Bond Donor/Acceptor

3 / 4

Safety Information

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Hazard Statement

Synonyms & References

English

Y27632 (HYDROCHLORIDE)
Y-27633 (2 HCl)
ROCK INHIBITOR
(+)-trans-N-(4-Pyridyl)-4-[(R)-1-aminoethyl]cyclohexanecarboxamide dihydrochloride
trans-4-[(R)-1-Aminoethyl]-N-(4-pyridyl)cyclohexanecarboxamide dihydrochloride
Y 27632 dihydrochloride (+)-trans-N-(4-Pyridyl)-4-[(R)-1-aminoethyl]cyclohexanecarboxamide dihydrochloride
(1R,4R)-4-((R)-1-Aminoethyl)-N-(pyridin-4-yl)cyclohexanecarboxamide dihydrochloride
Y27632
Y-27632
Y-27632 (hydrochloride)
Y27632 2hcl
Y-27632 2HCl
Y27632 HCl
Y-27632 dihydrochloride
Y 27632 dihydrochloride
(R)-(+)-trans-4-(1-Aminoethyl)-N-(4-Pyridyl)cyclohexanecarboxamide dihydrochloride
(R)-4-(1-aminoethyl)-N-(pyridin-4-yl)cyclohexanecarboxamide dihydrochloride
Y 27632 dihydrochloride (+)-trans-N-(4-Pyridyl)-4-[(R)-1-aminoethyl]cyclohexanecarboxamide dihydrochloride
trans-4-[(R)-1-Aminoethyl]-N-(4-pyridyl)cyclohexanecarboxamide dihydrochloride Y 27632 dihydrochloride
Y27632 (hydrochloride)
Y-27632 dihydrochloride, >=98%
Y-27632, Dihydrochloride Salt, >99%
Y-27632 dihydrochloride, 98.5%, a selective ROCK1 (p160ROCK) inhibitor

MDL Number

MFCD03490488

FAQ

What are the physical and chemical properties of trans-4-[(1R)-1-Aminoethyl]-N-(4-pyridinyl)cyclohexanecarboxamide dihydrochloride (CAS: 129830-38-2)?

The compound is a white crystalline solid with a molecular weight of approximately 310.23 g/mol. It has a solubility of about 10 mg/mL in water and exhibits low reactivity under normal conditions. The compound is stable under acidic and basic conditions but is sensitive to strong oxidizing agents.

How is trans-4-[(1R)-1-Aminoethyl]-N-(4-pyridinyl)cyclohexanecarboxamide dihydrochloride (CAS: 129830-38-2) typically synthesized?

The compound is typically synthesized through a multi-step process involving the reaction of 4-pyridinecarboxamide with a chiral amine to form the cyclohexanecarboxamide intermediate, followed by hydrochloride salt formation. The synthesis involves the use of a chiral catalyst for high selectivity and yield.

What industries use trans-4-[(1R)-1-Aminoethyl]-N-(4-pyridinyl)cyclohexanecarboxamide dihydrochloride (CAS: 129830-38-2)?

This compound is primarily used in the pharmaceutical industry for its potential as a drug candidate. It may also find applications in the polymer industry for its chemical properties and in sensor technology for its reactivity with specific analytes.

What precautions should be taken when handling trans-4-[(1R)-1-Aminoethyl]-N-(4-pyridinyl)cyclohexanecarboxamide dihydrochloride (CAS: 129830-38-2)?

When handling the compound, ensure the use of personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Store it in a fume hood and avoid contact with skin and eyes. In case of spill, immediately clean up using appropriate absorbent materials and consult the Safety Data Sheet (SDS) for further instructions.