2-chloro-N-methyl-6-(methylamino)-N-(3-methylcyclohexyl)pyridine-4-carboxamide

C15H22ClN3O — CID 62179291

IUPAC2-chloro-N-methyl-6-(methylamino)-N-(3-methylcyclohexyl)pyridine-4-carboxamide
SMILESCNc1cc(C(=O)N(C)C2CCCC(C)C2)cc(Cl)n1
InChIInChI=1S/C15H22ClN3O/c1-10-5-4-6-12(7-10)19(3)15(20)11-8-13(16)18-14(9-11)17-2/h8-10,12H,4-7H2,1-3H3,(H,17,18)
InChIKeyKQTOKGCAWCOJNG-UHFFFAOYSA-N
MW295.81 g/mol
LogP3.43
Rot. Bonds3

About 2-chloro-N-methyl-6-(methylamino)-N-(3-methylcyclohexyl)pyridine-4-carboxamide

2-chloro-N-methyl-6-(methylamino)-N-(3-methylcyclohexyl)pyridine-4-carboxamide (PubChem CID 62179291) has the molecular formula C15H22ClN3O and a molecular weight of 295.81 g/mol. Its IUPAC name is 2-chloro-N-methyl-6-(methylamino)-N-(3-methylcyclohexyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-chloro-N-methyl-6-(methylamino)-N-(3-methylcyclohexyl)pyridine-4-carboxamide
PubChem CID62179291
Molecular FormulaC15H22ClN3O
Molecular Weight295.81 g/mol
Exact Mass295.15
IUPAC Name2-chloro-N-methyl-6-(methylamino)-N-(3-methylcyclohexyl)pyridine-4-carboxamide
SMILESCNc1cc(C(=O)N(C)C2CCCC(C)C2)cc(Cl)n1
InChIInChI=1S/C15H22ClN3O/c1-10-5-4-6-12(7-10)19(3)15(20)11-8-13(16)18-14(9-11)17-2/h8-10,12H,4-7H2,1-3H3,(H,17,18)
InChIKeyKQTOKGCAWCOJNG-UHFFFAOYSA-N
XLogP3.43
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.81
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 2-chloro-N-methyl-6-(methylamino)-N-(3-methylcyclohexyl)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

2-chloro-6-(ethylamino)-N-methyl-N-(3-methylcyclohexyl)pyridine-4-carboxamide
CID 62179292
2-chloro-N-methyl-6-(methylamino)-N-(1-methylpiperidin-3-yl)pyridine-4-carboxamide
CID 62542296
2-chloro-N-methyl-6-(methylamino)-N-(2-methyloxolan-3-yl)pyridine-4-carboxamide
CID 82743811
2,6-dichloro-N-cyclohexyl-N-methylpyridine-4-carboxamide
CID 43235774
2-chloro-N-cyclopropyl-6-hydrazinyl-N-methylpyridine-4-carboxamide
CID 62243916
2-chloro-N-[2-[cyclopentyl(methyl)amino]ethyl]-6-(methylamino)pyridine-4-carboxamide
CID 63317161
2-chloro-N-cyclopropyl-N-(2-hydroxyethyl)-6-(methylamino)pyridine-4-carboxamide
CID 62177130
6-chloro-N-methyl-N-(3-methylcyclohexyl)pyridazine-3-carboxamide
CID 54949412
3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazin-4-yl-[2-chloro-6-(methylamino)-4-pyridinyl]methanone
CID 62174892
2-chloro-N-cycloheptyl-6-(methylamino)pyridine-4-carboxamide
CID 62165625
3-[methyl-(3-methylcyclohexyl)carbamoyl]benzoic acid
CID 61447304
3-chloro-6-hydrazinyl-N-methyl-N-(3-methylcyclohexyl)pyridine-2-carboxamide
CID 62237373

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-methyl-6-(methylamino)-N-(3-methylcyclohexyl)pyridine-4-carboxamide?
The IUPAC name of 2-chloro-N-methyl-6-(methylamino)-N-(3-methylcyclohexyl)pyridine-4-carboxamide (CID 62179291) is 2-chloro-N-methyl-6-(methylamino)-N-(3-methylcyclohexyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-chloro-N-methyl-6-(methylamino)-N-(3-methylcyclohexyl)pyridine-4-carboxamide?
The canonical SMILES for 2-chloro-N-methyl-6-(methylamino)-N-(3-methylcyclohexyl)pyridine-4-carboxamide is CNc1cc(C(=O)N(C)C2CCCC(C)C2)cc(Cl)n1.
What is the InChIKey of 2-chloro-N-methyl-6-(methylamino)-N-(3-methylcyclohexyl)pyridine-4-carboxamide?
The InChIKey is KQTOKGCAWCOJNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22ClN3O/c1-10-5-4-6-12(7-10)19(3)15(20)11-8-13(16)18-14(9-11)17-2/h8-10,12H,4-7H2,1-3H3,(H,17,18).
What are the key properties of 2-chloro-N-methyl-6-(methylamino)-N-(3-methylcyclohexyl)pyridine-4-carboxamide?
2-chloro-N-methyl-6-(methylamino)-N-(3-methylcyclohexyl)pyridine-4-carboxamide has a molecular weight of 295.81 g/mol, XLogP of 3.43, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-methyl-6-(methylamino)-N-(3-methylcyclohexyl)pyridine-4-carboxamide is sourced from PubChem (CID 62179291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).