3-[(R)-amino(cyclohexyl)methyl]pyridin-2-amine;hydrochloride

C12H20ClN3 — CID 171211332

IUPAC3-[(R)-amino(cyclohexyl)methyl]pyridin-2-amine;hydrochloride
SMILESCl.Nc1ncccc1[C@H](N)C1CCCCC1
InChIInChI=1S/C12H19N3.ClH/c13-11(9-5-2-1-3-6-9)10-7-4-8-15-12(10)14;/h4,7-9,11H,1-3,5-6,13H2,(H2,14,15);1H/t11-;/m1./s1
InChIKeyCYGCUPWOIAXCON-RFVHGSKJSA-N
MW241.77 g/mol
LogP2.67
Rot. Bonds2

About 3-[(R)-amino(cyclohexyl)methyl]pyridin-2-amine;hydrochloride

3-[(R)-amino(cyclohexyl)methyl]pyridin-2-amine;hydrochloride (PubChem CID 171211332) has the molecular formula C12H20ClN3 and a molecular weight of 241.77 g/mol. Its IUPAC name is 3-[(R)-amino(cyclohexyl)methyl]pyridin-2-amine;hydrochloride.

Molecular Properties

Compound Name3-[(R)-amino(cyclohexyl)methyl]pyridin-2-amine;hydrochloride
PubChem CID171211332
Molecular FormulaC12H20ClN3
Molecular Weight241.77 g/mol
Exact Mass241.13
IUPAC Name3-[(R)-amino(cyclohexyl)methyl]pyridin-2-amine;hydrochloride
SMILESCl.Nc1ncccc1[C@H](N)C1CCCCC1
InChIInChI=1S/C12H19N3.ClH/c13-11(9-5-2-1-3-6-9)10-7-4-8-15-12(10)14;/h4,7-9,11H,1-3,5-6,13H2,(H2,14,15);1H/t11-;/m1./s1
InChIKeyCYGCUPWOIAXCON-RFVHGSKJSA-N
XLogP2.67
TPSA64.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.77
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(R)-cyclopentyl-(2-fluoro-3-pyridinyl)methanamine
CID 130632989
3-[amino-(3-methylcyclopentyl)methyl]pyridin-2-amine
CID 65415376
(R)-(2-chloro-3-pyridinyl)-cyclobutylmethanamine
CID 131061254
3-[cyclopentyl(hydrazinyl)methyl]pyridin-2-amine
CID 105204361
3-(1-amino-2-cyclohexyl-2-ethoxyethyl)pyridin-2-amine
CID 116772126
(R)-(2-bromo-3-pyridinyl)-cyclopropylmethanamine
CID 124518533
cyclohexyl-(2-iodophenyl)methanamine
CID 112630996
cycloheptyl-(2-iodophenyl)methanamine
CID 105027819
2-[(S)-amino(cyclopentyl)methyl]phenol
CID 130665653
3-N-cyclohexylpyridine-2,3-diamine
CID 59587824
(S)-cyclohexyl(pyridin-3-yl)methanamine
CID 51888927
(R)-(2-chloro-3-pyridinyl)-(oxan-4-yl)methanamine;hydrochloride
CID 171245874

Frequently Asked Questions

What is the IUPAC name of 3-[(R)-amino(cyclohexyl)methyl]pyridin-2-amine;hydrochloride?
The IUPAC name of 3-[(R)-amino(cyclohexyl)methyl]pyridin-2-amine;hydrochloride (CID 171211332) is 3-[(R)-amino(cyclohexyl)methyl]pyridin-2-amine;hydrochloride.
What is the SMILES notation for 3-[(R)-amino(cyclohexyl)methyl]pyridin-2-amine;hydrochloride?
The canonical SMILES for 3-[(R)-amino(cyclohexyl)methyl]pyridin-2-amine;hydrochloride is Cl.Nc1ncccc1[C@H](N)C1CCCCC1.
What is the InChIKey of 3-[(R)-amino(cyclohexyl)methyl]pyridin-2-amine;hydrochloride?
The InChIKey is CYGCUPWOIAXCON-RFVHGSKJSA-N. The full InChI is InChI=1S/C12H19N3.ClH/c13-11(9-5-2-1-3-6-9)10-7-4-8-15-12(10)14;/h4,7-9,11H,1-3,5-6,13H2,(H2,14,15);1H/t11-;/m1./s1.
What are the key properties of 3-[(R)-amino(cyclohexyl)methyl]pyridin-2-amine;hydrochloride?
3-[(R)-amino(cyclohexyl)methyl]pyridin-2-amine;hydrochloride has a molecular weight of 241.77 g/mol, XLogP of 2.67, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(R)-amino(cyclohexyl)methyl]pyridin-2-amine;hydrochloride is sourced from PubChem (CID 171211332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).