2-[[4-(2-methylpropyl)cyclohexyl]methyl]pyridine

C16H25N — CID 129147354

IUPAC2-[[4-(2-methylpropyl)cyclohexyl]methyl]pyridine
SMILESCC(C)CC1CCC(Cc2ccccn2)CC1
InChIInChI=1S/C16H25N/c1-13(2)11-14-6-8-15(9-7-14)12-16-5-3-4-10-17-16/h3-5,10,13-15H,6-9,11-12H2,1-2H3
InChIKeyGMVCFFODUUJISY-UHFFFAOYSA-N
MW231.38 g/mol
LogP4.48
Rot. Bonds4

About 2-[[4-(2-methylpropyl)cyclohexyl]methyl]pyridine

2-[[4-(2-methylpropyl)cyclohexyl]methyl]pyridine (PubChem CID 129147354) has the molecular formula C16H25N and a molecular weight of 231.38 g/mol. Its IUPAC name is 2-[[4-(2-methylpropyl)cyclohexyl]methyl]pyridine.

Molecular Properties

Compound Name2-[[4-(2-methylpropyl)cyclohexyl]methyl]pyridine
PubChem CID129147354
Molecular FormulaC16H25N
Molecular Weight231.38 g/mol
Exact Mass231.20
IUPAC Name2-[[4-(2-methylpropyl)cyclohexyl]methyl]pyridine
SMILESCC(C)CC1CCC(Cc2ccccn2)CC1
InChIInChI=1S/C16H25N/c1-13(2)11-14-6-8-15(9-7-14)12-16-5-3-4-10-17-16/h3-5,10,13-15H,6-9,11-12H2,1-2H3
InChIKeyGMVCFFODUUJISY-UHFFFAOYSA-N
XLogP4.48
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.38
LogP ≤ 54.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2-[[4-(2-methylpropyl)cyclohexyl]methyl]pyridine 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

2-[[1-(2-methylpropyl)piperidin-4-yl]methyl]pyridine
CID 174571259
2-[[4-(2,2-dimethylpropyl)cyclohexyl]methyl]pyridine
CID 58318500
2-(cyclohexylmethyl)pyridine
CID 14762660
2-(1-cyclopropylethoxymethyl)pyridine
CID 88973388
2-(2-cyclopropyl-3-methylbutyl)pyridine
CID 54206046
2-(pyrrolidin-3-ylmethyl)pyridine;hydrochloride
CID 86262770
2-methyl-N-[[2-(pyridin-2-ylmethyl)cyclopentyl]methyl]propan-1-amine
CID 81028060
2-[(1,2-dimethylpiperidin-4-yl)methyl]pyridine
CID 174968091
2-(2-bromo-3-cyclopropylbutyl)pyridine
CID 83152951
2-[(4-propan-2-ylpiperidin-1-ium-1-yl)methyl]pyridine
CID 162490805
3-cyclopropyl-1-pyridin-2-ylbutan-2-amine
CID 83155129
1-[3-(pyridin-2-ylmethyl)piperidin-1-yl]ethanone
CID 110254207

Frequently Asked Questions

What is the IUPAC name of 2-[[4-(2-methylpropyl)cyclohexyl]methyl]pyridine?
The IUPAC name of 2-[[4-(2-methylpropyl)cyclohexyl]methyl]pyridine (CID 129147354) is 2-[[4-(2-methylpropyl)cyclohexyl]methyl]pyridine.
What is the SMILES notation for 2-[[4-(2-methylpropyl)cyclohexyl]methyl]pyridine?
The canonical SMILES for 2-[[4-(2-methylpropyl)cyclohexyl]methyl]pyridine is CC(C)CC1CCC(Cc2ccccn2)CC1.
What is the InChIKey of 2-[[4-(2-methylpropyl)cyclohexyl]methyl]pyridine?
The InChIKey is GMVCFFODUUJISY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N/c1-13(2)11-14-6-8-15(9-7-14)12-16-5-3-4-10-17-16/h3-5,10,13-15H,6-9,11-12H2,1-2H3.
What are the key properties of 2-[[4-(2-methylpropyl)cyclohexyl]methyl]pyridine?
2-[[4-(2-methylpropyl)cyclohexyl]methyl]pyridine has a molecular weight of 231.38 g/mol, XLogP of 4.48, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[4-(2-methylpropyl)cyclohexyl]methyl]pyridine is sourced from PubChem (CID 129147354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).