5-[methyl-(4-methylcyclohexyl)carbamoyl]pyridine-2-carboxylic acid

C15H20N2O3 — CID 60725247

IUPAC5-[methyl-(4-methylcyclohexyl)carbamoyl]pyridine-2-carboxylic acid
SMILESCC1CCC(N(C)C(=O)c2ccc(C(=O)O)nc2)CC1
InChIInChI=1S/C15H20N2O3/c1-10-3-6-12(7-4-10)17(2)14(18)11-5-8-13(15(19)20)16-9-11/h5,8-10,12H,3-4,6-7H2,1-2H3,(H,19,20)
InChIKeyNMPVMDOWWKNGKQ-UHFFFAOYSA-N
MW276.34 g/mol
LogP2.43
Rot. Bonds3

About 5-[methyl-(4-methylcyclohexyl)carbamoyl]pyridine-2-carboxylic acid

5-[methyl-(4-methylcyclohexyl)carbamoyl]pyridine-2-carboxylic acid (PubChem CID 60725247) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is 5-[methyl-(4-methylcyclohexyl)carbamoyl]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name5-[methyl-(4-methylcyclohexyl)carbamoyl]pyridine-2-carboxylic acid
PubChem CID60725247
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC Name5-[methyl-(4-methylcyclohexyl)carbamoyl]pyridine-2-carboxylic acid
SMILESCC1CCC(N(C)C(=O)c2ccc(C(=O)O)nc2)CC1
InChIInChI=1S/C15H20N2O3/c1-10-3-6-12(7-4-10)17(2)14(18)11-5-8-13(15(19)20)16-9-11/h5,8-10,12H,3-4,6-7H2,1-2H3,(H,19,20)
InChIKeyNMPVMDOWWKNGKQ-UHFFFAOYSA-N
XLogP2.43
TPSA70.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-[methyl-(4-methylcyclohexyl)carbamoyl]pyridine-2-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

N-methyl-N-(4-methylcyclohexyl)-6-(trifluoromethyl)pyridine-3-carboxamide
CID 134026117
5-(N'-hydroxycarbamimidoyl)-N-methyl-N-(4-methylcyclohexyl)pyridine-2-carboxamide
CID 77005098
N-methyl-N-(4-methylcyclohexyl)-6-morpholin-4-ylpyridine-3-carboxamide
CID 47018145
N-methyl-N-(4-methylcyclohexyl)-6-(propylamino)pyridine-3-carboxamide
CID 62178480
5-[methyl-[(1S,2R)-2-methylsulfonylcyclohexyl]carbamoyl]pyridine-2-carboxylic acid
CID 125119082
N-methyl-N-(4-methylcyclohexyl)-4-methylsulfonylbenzamide
CID 25482097
2-N-cycloheptyl-2-N-methylpyridine-2,5-dicarboxamide
CID 51098301
5-[butyl(methyl)carbamoyl]pyridine-2-carboxylic acid
CID 43414824
5-[cyclopropyl(1-methylsulfonylpropan-2-yl)carbamoyl]pyridine-2-carboxylic acid
CID 119129619
6-[methyl-(4-methylcyclohexyl)sulfamoyl]pyridine-3-carboxylic acid
CID 63874679
N-methyl-N-(1-methylpiperidin-4-yl)-6-phenylpyridine-3-carboxamide
CID 42802995
6-chloro-N-methyl-N-(4-phenylcyclohexyl)pyridine-3-carboxamide
CID 134022024

Frequently Asked Questions

What is the IUPAC name of 5-[methyl-(4-methylcyclohexyl)carbamoyl]pyridine-2-carboxylic acid?
The IUPAC name of 5-[methyl-(4-methylcyclohexyl)carbamoyl]pyridine-2-carboxylic acid (CID 60725247) is 5-[methyl-(4-methylcyclohexyl)carbamoyl]pyridine-2-carboxylic acid.
What is the SMILES notation for 5-[methyl-(4-methylcyclohexyl)carbamoyl]pyridine-2-carboxylic acid?
The canonical SMILES for 5-[methyl-(4-methylcyclohexyl)carbamoyl]pyridine-2-carboxylic acid is CC1CCC(N(C)C(=O)c2ccc(C(=O)O)nc2)CC1.
What is the InChIKey of 5-[methyl-(4-methylcyclohexyl)carbamoyl]pyridine-2-carboxylic acid?
The InChIKey is NMPVMDOWWKNGKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3/c1-10-3-6-12(7-4-10)17(2)14(18)11-5-8-13(15(19)20)16-9-11/h5,8-10,12H,3-4,6-7H2,1-2H3,(H,19,20).
What are the key properties of 5-[methyl-(4-methylcyclohexyl)carbamoyl]pyridine-2-carboxylic acid?
5-[methyl-(4-methylcyclohexyl)carbamoyl]pyridine-2-carboxylic acid has a molecular weight of 276.34 g/mol, XLogP of 2.43, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[methyl-(4-methylcyclohexyl)carbamoyl]pyridine-2-carboxylic acid is sourced from PubChem (CID 60725247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).