2-(cyclohexylmethyl)pyridine

C12H17N — CID 14762660

IUPAC2-(cyclohexylmethyl)pyridine
SMILESc1ccc(CC2CCCCC2)nc1
InChIInChI=1S/C12H17N/c1-2-6-11(7-3-1)10-12-8-4-5-9-13-12/h4-5,8-9,11H,1-3,6-7,10H2
InChIKeyMOOHIXDFNMSRCE-UHFFFAOYSA-N
MW175.28 g/mol
LogP3.20
Rot. Bonds2

About 2-(cyclohexylmethyl)pyridine

2-(cyclohexylmethyl)pyridine (PubChem CID 14762660) has the molecular formula C12H17N and a molecular weight of 175.28 g/mol. Its IUPAC name is 2-(cyclohexylmethyl)pyridine.

Molecular Properties

Compound Name2-(cyclohexylmethyl)pyridine
PubChem CID14762660
Molecular FormulaC12H17N
Molecular Weight175.28 g/mol
Exact Mass175.14
IUPAC Name2-(cyclohexylmethyl)pyridine
SMILESc1ccc(CC2CCCCC2)nc1
InChIInChI=1S/C12H17N/c1-2-6-11(7-3-1)10-12-8-4-5-9-13-12/h4-5,8-9,11H,1-3,6-7,10H2
InChIKeyMOOHIXDFNMSRCE-UHFFFAOYSA-N
XLogP3.20
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.28
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-[[4-(2,2-dimethylpropyl)cyclohexyl]methyl]pyridine
CID 58318500
2-[[4-(2-methylpropyl)cyclohexyl]methyl]pyridine
CID 129147354
2-[[(3R)-1-(pyridin-2-ylmethyl)piperidin-3-yl]methyl]pyridine
CID 95844895
1-[3-(pyridin-2-ylmethyl)piperidin-1-yl]ethanone
CID 110254207
(2S)-1-(cyclohexylmethylamino)-3-pyridin-2-ylpropan-2-ol
CID 70411130
2-(pyrrolidin-3-ylmethyl)pyridine;hydrochloride
CID 86262770
2-[[1-(2-methylpropyl)piperidin-4-yl]methyl]pyridine
CID 174571259
1-cyclohexyl-4-pyridin-2-ylbutan-2-one
CID 105089148
2-[[(2S)-pyrrolidin-1-ium-2-yl]methyl]pyridine
CID 7047988
cis-(1R,2S)-2-(pyridin-2-ylmethyl)cyclopentan-1-amine
CID 96630031
2-[(1-pyrrolidin-1-ylsulfonylpiperidin-3-yl)methyl]pyridine
CID 110096214
(2S)-N-(cyclohexylmethyl)-2-hydroxy-3-pyridin-2-ylpropanamide
CID 70412443

Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexylmethyl)pyridine?
The IUPAC name of 2-(cyclohexylmethyl)pyridine (CID 14762660) is 2-(cyclohexylmethyl)pyridine.
What is the SMILES notation for 2-(cyclohexylmethyl)pyridine?
The canonical SMILES for 2-(cyclohexylmethyl)pyridine is c1ccc(CC2CCCCC2)nc1.
What is the InChIKey of 2-(cyclohexylmethyl)pyridine?
The InChIKey is MOOHIXDFNMSRCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N/c1-2-6-11(7-3-1)10-12-8-4-5-9-13-12/h4-5,8-9,11H,1-3,6-7,10H2.
What are the key properties of 2-(cyclohexylmethyl)pyridine?
2-(cyclohexylmethyl)pyridine has a molecular weight of 175.28 g/mol, XLogP of 3.20, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexylmethyl)pyridine is sourced from PubChem (CID 14762660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).