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

C16H24ClN3O — CID 62179292

IUPAC2-chloro-6-(ethylamino)-N-methyl-N-(3-methylcyclohexyl)pyridine-4-carboxamide
SMILESCCNc1cc(C(=O)N(C)C2CCCC(C)C2)cc(Cl)n1
InChIInChI=1S/C16H24ClN3O/c1-4-18-15-10-12(9-14(17)19-15)16(21)20(3)13-7-5-6-11(2)8-13/h9-11,13H,4-8H2,1-3H3,(H,18,19)
InChIKeyLPIFHVJPRHUUTF-UHFFFAOYSA-N
MW309.84 g/mol
LogP3.82
Rot. Bonds4

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

2-chloro-6-(ethylamino)-N-methyl-N-(3-methylcyclohexyl)pyridine-4-carboxamide (PubChem CID 62179292) has the molecular formula C16H24ClN3O and a molecular weight of 309.84 g/mol. Its IUPAC name is 2-chloro-6-(ethylamino)-N-methyl-N-(3-methylcyclohexyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-chloro-6-(ethylamino)-N-methyl-N-(3-methylcyclohexyl)pyridine-4-carboxamide
PubChem CID62179292
Molecular FormulaC16H24ClN3O
Molecular Weight309.84 g/mol
Exact Mass309.16
IUPAC Name2-chloro-6-(ethylamino)-N-methyl-N-(3-methylcyclohexyl)pyridine-4-carboxamide
SMILESCCNc1cc(C(=O)N(C)C2CCCC(C)C2)cc(Cl)n1
InChIInChI=1S/C16H24ClN3O/c1-4-18-15-10-12(9-14(17)19-15)16(21)20(3)13-7-5-6-11(2)8-13/h9-11,13H,4-8H2,1-3H3,(H,18,19)
InChIKeyLPIFHVJPRHUUTF-UHFFFAOYSA-N
XLogP3.82
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.84
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-chloro-N-methyl-6-(methylamino)-N-(3-methylcyclohexyl)pyridine-4-carboxamide
CID 62179291
2-chloro-N-cyclopentyl-N-ethyl-6-(ethylamino)pyridine-4-carboxamide
CID 62169890
2-chloro-N-(cyclobutylmethyl)-6-(ethylamino)-N-methylpyridine-4-carboxamide
CID 62855903
2-chloro-N-(cyclopentylmethyl)-6-(ethylamino)-N-methylpyridine-4-carboxamide
CID 63657981
2-chloro-N-cyclopropyl-6-(ethylamino)-N-propylpyridine-4-carboxamide
CID 62169478
4-(ethylamino)-N-methyl-N-(3-methylcyclohexyl)benzamide
CID 62179470
5-(ethylamino)-N-methyl-N-(3-methylcyclohexyl)pyrazine-2-carboxamide
CID 107374833
2-chloro-6-(ethylamino)-N-methyl-N-(oxolan-2-ylmethyl)pyridine-4-carboxamide
CID 62173680
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-6-(ethylamino)-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]pyridine-4-carboxamide
CID 63274888
2-chloro-6-(ethylamino)-N-[(2-methylcyclopropyl)methyl]pyridine-4-carboxamide
CID 113464140

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-(ethylamino)-N-methyl-N-(3-methylcyclohexyl)pyridine-4-carboxamide?
The IUPAC name of 2-chloro-6-(ethylamino)-N-methyl-N-(3-methylcyclohexyl)pyridine-4-carboxamide (CID 62179292) is 2-chloro-6-(ethylamino)-N-methyl-N-(3-methylcyclohexyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-chloro-6-(ethylamino)-N-methyl-N-(3-methylcyclohexyl)pyridine-4-carboxamide?
The canonical SMILES for 2-chloro-6-(ethylamino)-N-methyl-N-(3-methylcyclohexyl)pyridine-4-carboxamide is CCNc1cc(C(=O)N(C)C2CCCC(C)C2)cc(Cl)n1.
What is the InChIKey of 2-chloro-6-(ethylamino)-N-methyl-N-(3-methylcyclohexyl)pyridine-4-carboxamide?
The InChIKey is LPIFHVJPRHUUTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24ClN3O/c1-4-18-15-10-12(9-14(17)19-15)16(21)20(3)13-7-5-6-11(2)8-13/h9-11,13H,4-8H2,1-3H3,(H,18,19).
What are the key properties of 2-chloro-6-(ethylamino)-N-methyl-N-(3-methylcyclohexyl)pyridine-4-carboxamide?
2-chloro-6-(ethylamino)-N-methyl-N-(3-methylcyclohexyl)pyridine-4-carboxamide has a molecular weight of 309.84 g/mol, XLogP of 3.82, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-(ethylamino)-N-methyl-N-(3-methylcyclohexyl)pyridine-4-carboxamide is sourced from PubChem (CID 62179292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).