(1R)-N-[(3-methylcyclohexyl)methyl]-1-pyridin-3-ylethanamine

C15H24N2 — CID 81404492

IUPAC(1R)-N-[(3-methylcyclohexyl)methyl]-1-pyridin-3-ylethanamine
SMILESCC1CCCC(CN[C@H](C)c2cccnc2)C1
InChIInChI=1S/C15H24N2/c1-12-5-3-6-14(9-12)10-17-13(2)15-7-4-8-16-11-15/h4,7-8,11-14,17H,3,5-6,9-10H2,1-2H3/t12?,13-,14?/m1/s1
InChIKeyGQNRLJMJKDFBET-ROKHWSDSSA-N
MW232.37 g/mol
LogP3.56
Rot. Bonds4

About (1R)-N-[(3-methylcyclohexyl)methyl]-1-pyridin-3-ylethanamine

(1R)-N-[(3-methylcyclohexyl)methyl]-1-pyridin-3-ylethanamine (PubChem CID 81404492) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is (1R)-N-[(3-methylcyclohexyl)methyl]-1-pyridin-3-ylethanamine.

Molecular Properties

Compound Name(1R)-N-[(3-methylcyclohexyl)methyl]-1-pyridin-3-ylethanamine
PubChem CID81404492
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name(1R)-N-[(3-methylcyclohexyl)methyl]-1-pyridin-3-ylethanamine
SMILESCC1CCCC(CN[C@H](C)c2cccnc2)C1
InChIInChI=1S/C15H24N2/c1-12-5-3-6-14(9-12)10-17-13(2)15-7-4-8-16-11-15/h4,7-8,11-14,17H,3,5-6,9-10H2,1-2H3/t12?,13-,14?/m1/s1
InChIKeyGQNRLJMJKDFBET-ROKHWSDSSA-N
XLogP3.56
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (1R)-N-[(3-methylcyclohexyl)methyl]-1-pyridin-3-ylethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(1S)-1-(4-bromophenyl)-N-[(3-methylcyclohexyl)methyl]ethanamine
CID 81359380
N-[(3-methylcyclohexyl)methyl]-1-(1H-pyrazol-4-yl)ethanamine
CID 103884007
(1S)-N-(oxolan-2-ylmethyl)-1-pyridin-3-ylethanamine
CID 81404067
1-(furan-3-yl)-N-[(3-methylcyclohexyl)methyl]ethanamine
CID 115712271
2,5-dimethyl-N-[(1R)-1-pyridin-3-ylethyl]cyclohexan-1-amine
CID 81406468
N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]-1-pyridin-3-ylethanamine
CID 61208112
N-(oxan-2-ylmethyl)-1-pyridin-3-ylethanamine
CID 43403760
4-ethyl-N-[(1S)-1-pyridin-3-ylethyl]cycloheptan-1-amine
CID 81407640
N-[(1S)-1-pyridin-3-ylethyl]cyclopropanamine
CID 26385082
N-(1-pyridin-3-ylethyl)cyclododecanamine
CID 43079395
N-[(1S)-1-pyridin-3-ylethyl]cycloheptanamine
CID 28646604
(1S)-1-(2-methoxyphenyl)-N-[(3-methylcyclohexyl)methyl]ethanamine
CID 81397121

Frequently Asked Questions

What is the IUPAC name of (1R)-N-[(3-methylcyclohexyl)methyl]-1-pyridin-3-ylethanamine?
The IUPAC name of (1R)-N-[(3-methylcyclohexyl)methyl]-1-pyridin-3-ylethanamine (CID 81404492) is (1R)-N-[(3-methylcyclohexyl)methyl]-1-pyridin-3-ylethanamine.
What is the SMILES notation for (1R)-N-[(3-methylcyclohexyl)methyl]-1-pyridin-3-ylethanamine?
The canonical SMILES for (1R)-N-[(3-methylcyclohexyl)methyl]-1-pyridin-3-ylethanamine is CC1CCCC(CN[C@H](C)c2cccnc2)C1.
What is the InChIKey of (1R)-N-[(3-methylcyclohexyl)methyl]-1-pyridin-3-ylethanamine?
The InChIKey is GQNRLJMJKDFBET-ROKHWSDSSA-N. The full InChI is InChI=1S/C15H24N2/c1-12-5-3-6-14(9-12)10-17-13(2)15-7-4-8-16-11-15/h4,7-8,11-14,17H,3,5-6,9-10H2,1-2H3/t12?,13-,14?/m1/s1.
What are the key properties of (1R)-N-[(3-methylcyclohexyl)methyl]-1-pyridin-3-ylethanamine?
(1R)-N-[(3-methylcyclohexyl)methyl]-1-pyridin-3-ylethanamine has a molecular weight of 232.37 g/mol, XLogP of 3.56, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-N-[(3-methylcyclohexyl)methyl]-1-pyridin-3-ylethanamine is sourced from PubChem (CID 81404492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).