3-chloro-N-(3,5-dimethylcyclohexyl)pyridine-4-carboxamide

C14H19ClN2O — CID 66482604

IUPAC3-chloro-N-(3,5-dimethylcyclohexyl)pyridine-4-carboxamide
SMILESCC1CC(C)CC(NC(=O)c2ccncc2Cl)C1
InChIInChI=1S/C14H19ClN2O/c1-9-5-10(2)7-11(6-9)17-14(18)12-3-4-16-8-13(12)15/h3-4,8-11H,5-7H2,1-2H3,(H,17,18)
InChIKeyWGJOFBDMUUTEOA-UHFFFAOYSA-N
MW266.77 g/mol
LogP3.29
Rot. Bonds2

About 3-chloro-N-(3,5-dimethylcyclohexyl)pyridine-4-carboxamide

3-chloro-N-(3,5-dimethylcyclohexyl)pyridine-4-carboxamide (PubChem CID 66482604) has the molecular formula C14H19ClN2O and a molecular weight of 266.77 g/mol. Its IUPAC name is 3-chloro-N-(3,5-dimethylcyclohexyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name3-chloro-N-(3,5-dimethylcyclohexyl)pyridine-4-carboxamide
PubChem CID66482604
Molecular FormulaC14H19ClN2O
Molecular Weight266.77 g/mol
Exact Mass266.12
IUPAC Name3-chloro-N-(3,5-dimethylcyclohexyl)pyridine-4-carboxamide
SMILESCC1CC(C)CC(NC(=O)c2ccncc2Cl)C1
InChIInChI=1S/C14H19ClN2O/c1-9-5-10(2)7-11(6-9)17-14(18)12-3-4-16-8-13(12)15/h3-4,8-11H,5-7H2,1-2H3,(H,17,18)
InChIKeyWGJOFBDMUUTEOA-UHFFFAOYSA-N
XLogP3.29
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.77
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-chloro-N-(3,5-dimethylcyclohexyl)pyridine-4-carboxamide 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-(3-aminocyclobutyl)-3-chloropyridine-4-carboxamide
CID 66482226
3-chloro-N-(2,2-dimethyloxan-4-yl)pyridine-4-carboxamide
CID 113336639
3-chloro-N-pyrrolidin-3-ylpyridine-4-carboxamide;dihydrochloride
CID 119452044
3-chloro-N-(5-methyl-2-propan-2-ylcyclohexyl)pyridine-4-carboxamide
CID 66482936
2-chloro-N-(3,5-dimethylcyclohexyl)-4-nitrobenzamide
CID 64723347
3-chloro-N-[4-(2-methylbutan-2-yl)cyclohexyl]pyridine-4-carboxamide
CID 66482736
3-chloro-N-(1-propylpiperidin-4-yl)pyridine-4-carboxamide
CID 66484717
4-[(3-chloropyridine-4-carbonyl)amino]cyclopent-2-ene-1-carboxylic acid
CID 79210100
N-(azepan-3-yl)-3-chloropyridine-4-carboxamide
CID 66482428
3-chloro-N-piperidin-3-ylpyridine-4-carboxamide;dihydrochloride
CID 119426879
(3-chloro-4-pyridinyl)-(3,4-dimethylcyclohexyl)methanone
CID 105105379
1-[(3-chloropyridine-4-carbonyl)amino]-4-methylcyclohexane-1-carboxylic acid
CID 66462007

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-(3,5-dimethylcyclohexyl)pyridine-4-carboxamide?
The IUPAC name of 3-chloro-N-(3,5-dimethylcyclohexyl)pyridine-4-carboxamide (CID 66482604) is 3-chloro-N-(3,5-dimethylcyclohexyl)pyridine-4-carboxamide.
What is the SMILES notation for 3-chloro-N-(3,5-dimethylcyclohexyl)pyridine-4-carboxamide?
The canonical SMILES for 3-chloro-N-(3,5-dimethylcyclohexyl)pyridine-4-carboxamide is CC1CC(C)CC(NC(=O)c2ccncc2Cl)C1.
What is the InChIKey of 3-chloro-N-(3,5-dimethylcyclohexyl)pyridine-4-carboxamide?
The InChIKey is WGJOFBDMUUTEOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O/c1-9-5-10(2)7-11(6-9)17-14(18)12-3-4-16-8-13(12)15/h3-4,8-11H,5-7H2,1-2H3,(H,17,18).
What are the key properties of 3-chloro-N-(3,5-dimethylcyclohexyl)pyridine-4-carboxamide?
3-chloro-N-(3,5-dimethylcyclohexyl)pyridine-4-carboxamide has a molecular weight of 266.77 g/mol, XLogP of 3.29, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-(3,5-dimethylcyclohexyl)pyridine-4-carboxamide is sourced from PubChem (CID 66482604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).