6-methyl-4-[methyl-(3-methylcyclohexyl)amino]pyridine-3-carboxylic acid

C15H22N2O2 — CID 81233162

IUPAC6-methyl-4-[methyl-(3-methylcyclohexyl)amino]pyridine-3-carboxylic acid
SMILESCc1cc(N(C)C2CCCC(C)C2)c(C(=O)O)cn1
InChIInChI=1S/C15H22N2O2/c1-10-5-4-6-12(7-10)17(3)14-8-11(2)16-9-13(14)15(18)19/h8-10,12H,4-7H2,1-3H3,(H,18,19)
InChIKeySHXIZAJVLUNWAS-UHFFFAOYSA-N
MW262.35 g/mol
LogP3.10
Rot. Bonds3

About 6-methyl-4-[methyl-(3-methylcyclohexyl)amino]pyridine-3-carboxylic acid

6-methyl-4-[methyl-(3-methylcyclohexyl)amino]pyridine-3-carboxylic acid (PubChem CID 81233162) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 6-methyl-4-[methyl-(3-methylcyclohexyl)amino]pyridine-3-carboxylic acid.

Molecular Properties

Compound Name6-methyl-4-[methyl-(3-methylcyclohexyl)amino]pyridine-3-carboxylic acid
PubChem CID81233162
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name6-methyl-4-[methyl-(3-methylcyclohexyl)amino]pyridine-3-carboxylic acid
SMILESCc1cc(N(C)C2CCCC(C)C2)c(C(=O)O)cn1
InChIInChI=1S/C15H22N2O2/c1-10-5-4-6-12(7-10)17(3)14-8-11(2)16-9-13(14)15(18)19/h8-10,12H,4-7H2,1-3H3,(H,18,19)
InChIKeySHXIZAJVLUNWAS-UHFFFAOYSA-N
XLogP3.10
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-methyl-4-[methyl-(3-methylcyclohexyl)amino]pyridine-3-carboxylic acid 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

5-bromo-2-[methyl-(3-methylcyclohexyl)amino]benzoic acid
CID 114895667
N,2-dimethyl-5-(methylaminomethyl)-N-(3-methylcyclohexyl)pyridin-4-amine
CID 81246363
4-[cyclopentyl(2-hydroxyethyl)amino]-6-methylpyridine-3-carboxylic acid
CID 81244159
2,3-difluoro-4-[methyl-(3-methylcyclohexyl)amino]benzoic acid
CID 107935646
4-[cyclopentyl(2-methylpropyl)amino]-6-methylpyridine-3-carboxylic acid
CID 81244045
6-methyl-4-(3-methylcyclohexyl)sulfanylpyridine-3-carboxylic acid
CID 81239015
5-amino-6-[methyl-(3-methylcyclohexyl)amino]pyridine-3-carboxylic acid
CID 81440147
4-[methyl-(3-methylcyclohexyl)amino]benzoic acid
CID 61446292
6-methyl-4-[methyl(oxan-2-ylmethyl)amino]pyridine-3-carboxylic acid
CID 81233414
4-[2-cyanoethyl(cyclopropyl)amino]-6-methylpyridine-3-carboxylic acid
CID 81244340
2-chloro-6-[methyl-(3-methylcyclohexyl)amino]benzoic acid
CID 61446336
6-methyl-4-(4-methylpiperidin-1-yl)pyridine-3-carboxylic acid
CID 81233113

Frequently Asked Questions

What is the IUPAC name of 6-methyl-4-[methyl-(3-methylcyclohexyl)amino]pyridine-3-carboxylic acid?
The IUPAC name of 6-methyl-4-[methyl-(3-methylcyclohexyl)amino]pyridine-3-carboxylic acid (CID 81233162) is 6-methyl-4-[methyl-(3-methylcyclohexyl)amino]pyridine-3-carboxylic acid.
What is the SMILES notation for 6-methyl-4-[methyl-(3-methylcyclohexyl)amino]pyridine-3-carboxylic acid?
The canonical SMILES for 6-methyl-4-[methyl-(3-methylcyclohexyl)amino]pyridine-3-carboxylic acid is Cc1cc(N(C)C2CCCC(C)C2)c(C(=O)O)cn1.
What is the InChIKey of 6-methyl-4-[methyl-(3-methylcyclohexyl)amino]pyridine-3-carboxylic acid?
The InChIKey is SHXIZAJVLUNWAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-10-5-4-6-12(7-10)17(3)14-8-11(2)16-9-13(14)15(18)19/h8-10,12H,4-7H2,1-3H3,(H,18,19).
What are the key properties of 6-methyl-4-[methyl-(3-methylcyclohexyl)amino]pyridine-3-carboxylic acid?
6-methyl-4-[methyl-(3-methylcyclohexyl)amino]pyridine-3-carboxylic acid has a molecular weight of 262.35 g/mol, XLogP of 3.10, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4-[methyl-(3-methylcyclohexyl)amino]pyridine-3-carboxylic acid is sourced from PubChem (CID 81233162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).