3-chloro-N-cyclohexyl-6-(methylamino)pyridine-2-carboxamide

C13H18ClN3O — CID 62173028

IUPAC3-chloro-N-cyclohexyl-6-(methylamino)pyridine-2-carboxamide
SMILESCNc1ccc(Cl)c(C(=O)NC2CCCCC2)n1
InChIInChI=1S/C13H18ClN3O/c1-15-11-8-7-10(14)12(17-11)13(18)16-9-5-3-2-4-6-9/h7-9H,2-6H2,1H3,(H,15,17)(H,16,18)
InChIKeyYGZHKBKQJDLVHU-UHFFFAOYSA-N
MW267.76 g/mol
LogP2.84
Rot. Bonds3

About 3-chloro-N-cyclohexyl-6-(methylamino)pyridine-2-carboxamide

3-chloro-N-cyclohexyl-6-(methylamino)pyridine-2-carboxamide (PubChem CID 62173028) has the molecular formula C13H18ClN3O and a molecular weight of 267.76 g/mol. Its IUPAC name is 3-chloro-N-cyclohexyl-6-(methylamino)pyridine-2-carboxamide.

Molecular Properties

Compound Name3-chloro-N-cyclohexyl-6-(methylamino)pyridine-2-carboxamide
PubChem CID62173028
Molecular FormulaC13H18ClN3O
Molecular Weight267.76 g/mol
Exact Mass267.11
IUPAC Name3-chloro-N-cyclohexyl-6-(methylamino)pyridine-2-carboxamide
SMILESCNc1ccc(Cl)c(C(=O)NC2CCCCC2)n1
InChIInChI=1S/C13H18ClN3O/c1-15-11-8-7-10(14)12(17-11)13(18)16-9-5-3-2-4-6-9/h7-9H,2-6H2,1H3,(H,15,17)(H,16,18)
InChIKeyYGZHKBKQJDLVHU-UHFFFAOYSA-N
XLogP2.84
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.76
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-chloro-N-cyclobutyl-6-(methylamino)pyridine-2-carboxamide
CID 62415036
3-chloro-6-(methylamino)-N-(1-propylpiperidin-4-yl)pyridine-2-carboxamide
CID 62178316
3-chloro-N-(3-methoxycyclobutyl)-6-(methylamino)pyridine-2-carboxamide
CID 114120793
3-chloro-N-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)-6-(methylamino)pyridine-2-carboxamide
CID 62174078
3-chloro-N-(cyclobutylmethyl)-6-(methylamino)pyridine-2-carboxamide
CID 55042718
2-chloro-N-cycloheptyl-6-(methylamino)pyridine-4-carboxamide
CID 62165625
5-chloro-N-cyclobutyl-2-(methylamino)pyridine-4-carboxamide
CID 114923292
3-chloro-N-(1-cyclohexylethyl)-6-hydrazinylpyridine-2-carboxamide
CID 62406912
3-chloro-N-(2-cyclopentylethyl)-6-(ethylamino)pyridine-2-carboxamide
CID 62181281
3-chloro-N-(2,6-dichloro-3-methylphenyl)-6-(methylamino)pyridine-2-carboxamide
CID 62186267
4,5-dichloro-1-N,2-N-dicyclohexylbenzene-1,2-dicarboxamide
CID 23880547
3-chloro-N-(3,5-dichlorophenyl)-6-(methylamino)pyridine-2-carboxamide
CID 62173294

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-cyclohexyl-6-(methylamino)pyridine-2-carboxamide?
The IUPAC name of 3-chloro-N-cyclohexyl-6-(methylamino)pyridine-2-carboxamide (CID 62173028) is 3-chloro-N-cyclohexyl-6-(methylamino)pyridine-2-carboxamide.
What is the SMILES notation for 3-chloro-N-cyclohexyl-6-(methylamino)pyridine-2-carboxamide?
The canonical SMILES for 3-chloro-N-cyclohexyl-6-(methylamino)pyridine-2-carboxamide is CNc1ccc(Cl)c(C(=O)NC2CCCCC2)n1.
What is the InChIKey of 3-chloro-N-cyclohexyl-6-(methylamino)pyridine-2-carboxamide?
The InChIKey is YGZHKBKQJDLVHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18ClN3O/c1-15-11-8-7-10(14)12(17-11)13(18)16-9-5-3-2-4-6-9/h7-9H,2-6H2,1H3,(H,15,17)(H,16,18).
What are the key properties of 3-chloro-N-cyclohexyl-6-(methylamino)pyridine-2-carboxamide?
3-chloro-N-cyclohexyl-6-(methylamino)pyridine-2-carboxamide has a molecular weight of 267.76 g/mol, XLogP of 2.84, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-cyclohexyl-6-(methylamino)pyridine-2-carboxamide is sourced from PubChem (CID 62173028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).