(1S)-1-cyclopentyl-N-[(5-methyl-3-pyridinyl)methyl]ethanamine

C14H22N2 — CID 102880981

IUPAC(1S)-1-cyclopentyl-N-[(5-methyl-3-pyridinyl)methyl]ethanamine
SMILESCc1cncc(CN[C@@H](C)C2CCCC2)c1
InChIInChI=1S/C14H22N2/c1-11-7-13(9-15-8-11)10-16-12(2)14-5-3-4-6-14/h7-9,12,14,16H,3-6,10H2,1-2H3/t12-/m0/s1
InChIKeyPLGKFBWHLOYNTO-LBPRGKRZSA-N
MW218.34 g/mol
LogP3.06
Rot. Bonds4

About (1S)-1-cyclopentyl-N-[(5-methyl-3-pyridinyl)methyl]ethanamine

(1S)-1-cyclopentyl-N-[(5-methyl-3-pyridinyl)methyl]ethanamine (PubChem CID 102880981) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is (1S)-1-cyclopentyl-N-[(5-methyl-3-pyridinyl)methyl]ethanamine.

Molecular Properties

Compound Name(1S)-1-cyclopentyl-N-[(5-methyl-3-pyridinyl)methyl]ethanamine
PubChem CID102880981
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC Name(1S)-1-cyclopentyl-N-[(5-methyl-3-pyridinyl)methyl]ethanamine
SMILESCc1cncc(CN[C@@H](C)C2CCCC2)c1
InChIInChI=1S/C14H22N2/c1-11-7-13(9-15-8-11)10-16-12(2)14-5-3-4-6-14/h7-9,12,14,16H,3-6,10H2,1-2H3/t12-/m0/s1
InChIKeyPLGKFBWHLOYNTO-LBPRGKRZSA-N
XLogP3.06
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (1S)-1-cyclopentyl-N-[(5-methyl-3-pyridinyl)methyl]ethanamine 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-cyclohexyl-N-[(5-methyl-3-pyridinyl)methyl]ethanamine
CID 102880979
(1S)-N-[(5-bromo-3-pyridinyl)methyl]-1-cycloheptylethanamine
CID 104580020
(1R)-N-[(5-bromo-3-pyridinyl)methyl]-1-cycloheptylethanamine
CID 104580046
(1S)-1-cyclopentyl-N-[(3,5-dimethylphenyl)methyl]ethanamine
CID 81386110
(1R)-1-cyclopentyl-N-[(3,5-dimethylphenyl)methyl]ethanamine
CID 81395487
(1S)-1-cycloheptyl-N-(pyrimidin-5-ylmethyl)ethanamine
CID 81391282
(1R)-1-cyclopentyl-N-[(4-methylphenyl)methyl]ethanamine
CID 81394920
(1R)-1-cyclohexyl-N-(pyridin-3-ylmethyl)ethanamine
CID 81384480
(2S)-2-[(5-methyl-3-pyridinyl)methylamino]propan-1-ol
CID 167984285
4-[(1-cyclohexylethylamino)methyl]-2,6-dimethylphenol
CID 62405183
2,2-dicyclopropyl-N-[(5-methyl-3-pyridinyl)methyl]ethanamine
CID 102880910
N-(1-cyclopentylethyl)-5-methylpyridin-3-amine
CID 115922263

Frequently Asked Questions

What is the IUPAC name of (1S)-1-cyclopentyl-N-[(5-methyl-3-pyridinyl)methyl]ethanamine?
The IUPAC name of (1S)-1-cyclopentyl-N-[(5-methyl-3-pyridinyl)methyl]ethanamine (CID 102880981) is (1S)-1-cyclopentyl-N-[(5-methyl-3-pyridinyl)methyl]ethanamine.
What is the SMILES notation for (1S)-1-cyclopentyl-N-[(5-methyl-3-pyridinyl)methyl]ethanamine?
The canonical SMILES for (1S)-1-cyclopentyl-N-[(5-methyl-3-pyridinyl)methyl]ethanamine is Cc1cncc(CN[C@@H](C)C2CCCC2)c1.
What is the InChIKey of (1S)-1-cyclopentyl-N-[(5-methyl-3-pyridinyl)methyl]ethanamine?
The InChIKey is PLGKFBWHLOYNTO-LBPRGKRZSA-N. The full InChI is InChI=1S/C14H22N2/c1-11-7-13(9-15-8-11)10-16-12(2)14-5-3-4-6-14/h7-9,12,14,16H,3-6,10H2,1-2H3/t12-/m0/s1.
What are the key properties of (1S)-1-cyclopentyl-N-[(5-methyl-3-pyridinyl)methyl]ethanamine?
(1S)-1-cyclopentyl-N-[(5-methyl-3-pyridinyl)methyl]ethanamine has a molecular weight of 218.34 g/mol, XLogP of 3.06, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-cyclopentyl-N-[(5-methyl-3-pyridinyl)methyl]ethanamine is sourced from PubChem (CID 102880981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).