2-chloro-6-(ethylamino)-N-(1-methylcyclohexyl)pyridine-4-carboxamide

C15H22ClN3O — CID 62175112

IUPAC2-chloro-6-(ethylamino)-N-(1-methylcyclohexyl)pyridine-4-carboxamide
SMILESCCNc1cc(C(=O)NC2(C)CCCCC2)cc(Cl)n1
InChIInChI=1S/C15H22ClN3O/c1-3-17-13-10-11(9-12(16)18-13)14(20)19-15(2)7-5-4-6-8-15/h9-10H,3-8H2,1-2H3,(H,17,18)(H,19,20)
InChIKeyFVXDFJVBJZXDRM-UHFFFAOYSA-N
MW295.81 g/mol
LogP3.62
Rot. Bonds4

About 2-chloro-6-(ethylamino)-N-(1-methylcyclohexyl)pyridine-4-carboxamide

2-chloro-6-(ethylamino)-N-(1-methylcyclohexyl)pyridine-4-carboxamide (PubChem CID 62175112) has the molecular formula C15H22ClN3O and a molecular weight of 295.81 g/mol. Its IUPAC name is 2-chloro-6-(ethylamino)-N-(1-methylcyclohexyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-chloro-6-(ethylamino)-N-(1-methylcyclohexyl)pyridine-4-carboxamide
PubChem CID62175112
Molecular FormulaC15H22ClN3O
Molecular Weight295.81 g/mol
Exact Mass295.15
IUPAC Name2-chloro-6-(ethylamino)-N-(1-methylcyclohexyl)pyridine-4-carboxamide
SMILESCCNc1cc(C(=O)NC2(C)CCCCC2)cc(Cl)n1
InChIInChI=1S/C15H22ClN3O/c1-3-17-13-10-11(9-12(16)18-13)14(20)19-15(2)7-5-4-6-8-15/h9-10H,3-8H2,1-2H3,(H,17,18)(H,19,20)
InChIKeyFVXDFJVBJZXDRM-UHFFFAOYSA-N
XLogP3.62
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.81
LogP ≤ 53.62
H-Bond Donors ≤ 52
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-ethyl-6-(ethylamino)pyridine-4-carboxamide
CID 62172199
2,6-dichloro-N-(1-methylcyclobutyl)pyridine-4-carboxamide
CID 115766201
2-chloro-6-(ethylamino)-N-methylpyridine-4-carboxamide
CID 62171489
2-chloro-N-(2,2-dimethylcyclopentyl)-6-(ethylamino)pyridine-4-carboxamide
CID 79872955
2-chloro-6-(ethylamino)-N-(3-methylbutan-2-yl)pyridine-4-carboxamide
CID 62165976
2-chloro-6-(ethylamino)-N-[(2-methylcyclopropyl)methyl]pyridine-4-carboxamide
CID 113464140
2-chloro-6-(ethylamino)-N-(2-methylsulfinylethyl)pyridine-4-carboxamide
CID 113480509
2-chloro-6-(ethylamino)-N-[3-(methylamino)-3-oxopropyl]pyridine-4-carboxamide
CID 62175036
2-chloro-6-(ethylamino)-N-(thiolan-2-ylmethyl)pyridine-4-carboxamide
CID 80586203
2-chloro-6-(ethylamino)-N-(2-ethylcyclopropyl)pyridine-4-carboxamide
CID 114109652
2-chloro-6-(ethylamino)-N-(2-ethylcyclohexyl)pyridine-4-carboxamide
CID 63499362
2-chloro-6-(ethylamino)-N-pyridin-4-ylpyridine-4-carboxamide
CID 62167550

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-(ethylamino)-N-(1-methylcyclohexyl)pyridine-4-carboxamide?
The IUPAC name of 2-chloro-6-(ethylamino)-N-(1-methylcyclohexyl)pyridine-4-carboxamide (CID 62175112) is 2-chloro-6-(ethylamino)-N-(1-methylcyclohexyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-chloro-6-(ethylamino)-N-(1-methylcyclohexyl)pyridine-4-carboxamide?
The canonical SMILES for 2-chloro-6-(ethylamino)-N-(1-methylcyclohexyl)pyridine-4-carboxamide is CCNc1cc(C(=O)NC2(C)CCCCC2)cc(Cl)n1.
What is the InChIKey of 2-chloro-6-(ethylamino)-N-(1-methylcyclohexyl)pyridine-4-carboxamide?
The InChIKey is FVXDFJVBJZXDRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22ClN3O/c1-3-17-13-10-11(9-12(16)18-13)14(20)19-15(2)7-5-4-6-8-15/h9-10H,3-8H2,1-2H3,(H,17,18)(H,19,20).
What are the key properties of 2-chloro-6-(ethylamino)-N-(1-methylcyclohexyl)pyridine-4-carboxamide?
2-chloro-6-(ethylamino)-N-(1-methylcyclohexyl)pyridine-4-carboxamide has a molecular weight of 295.81 g/mol, XLogP of 3.62, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-(ethylamino)-N-(1-methylcyclohexyl)pyridine-4-carboxamide is sourced from PubChem (CID 62175112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).