(S)-cyclohexyl(pyridin-3-yl)methanamine

C12H18N2 — CID 51888927

IUPAC(S)-cyclohexyl(pyridin-3-yl)methanamine
SMILESN[C@H](c1cccnc1)C1CCCCC1
InChIInChI=1S/C12H18N2/c13-12(10-5-2-1-3-6-10)11-7-4-8-14-9-11/h4,7-10,12H,1-3,5-6,13H2/t12-/m0/s1
InChIKeyMGAMAQSNSVZIEY-LBPRGKRZSA-N
MW190.29 g/mol
LogP2.66
Rot. Bonds2

About (S)-cyclohexyl(pyridin-3-yl)methanamine

(S)-cyclohexyl(pyridin-3-yl)methanamine (PubChem CID 51888927) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is (S)-cyclohexyl(pyridin-3-yl)methanamine.

Molecular Properties

Compound Name(S)-cyclohexyl(pyridin-3-yl)methanamine
PubChem CID51888927
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC Name(S)-cyclohexyl(pyridin-3-yl)methanamine
SMILESN[C@H](c1cccnc1)C1CCCCC1
InChIInChI=1S/C12H18N2/c13-12(10-5-2-1-3-6-10)11-7-4-8-14-9-11/h4,7-10,12H,1-3,5-6,13H2/t12-/m0/s1
InChIKeyMGAMAQSNSVZIEY-LBPRGKRZSA-N
XLogP2.66
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(R)-oxan-4-yl(pyridin-3-yl)methanamine
CID 15549943
1-cyclohexyl-N-methyl-1-pyridin-3-ylmethanamine
CID 60817955
2-cyclohexyl-2-pyridin-3-ylacetonitrile
CID 82931254
(3,3-difluorocyclobutyl)-pyridin-3-ylmethanamine
CID 130992574
(3,4-dimethylcyclohexyl)-pyridin-3-ylmethanamine
CID 64738631
methyl (2S)-2-cyclopentyl-2-pyridin-3-ylacetate
CID 129395618
2-cyclohexyl-1-pyridin-3-ylethanol
CID 22768104
N-[(1S)-1-pyridin-3-ylethyl]cycloheptanamine
CID 28646604
N-(1-pyridin-3-ylethyl)cyclododecanamine
CID 43079395
(1R)-2-cyclopropyl-1-pyridin-3-ylethanamine;hydrochloride
CID 171201503
(1S)-2-cyclopropyl-1-pyridin-3-ylethanamine;hydrochloride
CID 171221041
(2-cyclopentyl-1-pyridin-3-ylethyl)hydrazine
CID 105196086

Frequently Asked Questions

What is the IUPAC name of (S)-cyclohexyl(pyridin-3-yl)methanamine?
The IUPAC name of (S)-cyclohexyl(pyridin-3-yl)methanamine (CID 51888927) is (S)-cyclohexyl(pyridin-3-yl)methanamine.
What is the SMILES notation for (S)-cyclohexyl(pyridin-3-yl)methanamine?
The canonical SMILES for (S)-cyclohexyl(pyridin-3-yl)methanamine is N[C@H](c1cccnc1)C1CCCCC1.
What is the InChIKey of (S)-cyclohexyl(pyridin-3-yl)methanamine?
The InChIKey is MGAMAQSNSVZIEY-LBPRGKRZSA-N. The full InChI is InChI=1S/C12H18N2/c13-12(10-5-2-1-3-6-10)11-7-4-8-14-9-11/h4,7-10,12H,1-3,5-6,13H2/t12-/m0/s1.
What are the key properties of (S)-cyclohexyl(pyridin-3-yl)methanamine?
(S)-cyclohexyl(pyridin-3-yl)methanamine has a molecular weight of 190.29 g/mol, XLogP of 2.66, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (S)-cyclohexyl(pyridin-3-yl)methanamine is sourced from PubChem (CID 51888927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).