3-chloro-N-(2,3-dimethylcyclohexyl)-6-(ethylamino)pyridine-2-carboxamide

C16H24ClN3O — CID 62165310

IUPAC3-chloro-N-(2,3-dimethylcyclohexyl)-6-(ethylamino)pyridine-2-carboxamide
SMILESCCNc1ccc(Cl)c(C(=O)NC2CCCC(C)C2C)n1
InChIInChI=1S/C16H24ClN3O/c1-4-18-14-9-8-12(17)15(20-14)16(21)19-13-7-5-6-10(2)11(13)3/h8-11,13H,4-7H2,1-3H3,(H,18,20)(H,19,21)
InChIKeyOFRAQELQTHFMOX-UHFFFAOYSA-N
MW309.84 g/mol
LogP3.72
Rot. Bonds4

About 3-chloro-N-(2,3-dimethylcyclohexyl)-6-(ethylamino)pyridine-2-carboxamide

3-chloro-N-(2,3-dimethylcyclohexyl)-6-(ethylamino)pyridine-2-carboxamide (PubChem CID 62165310) has the molecular formula C16H24ClN3O and a molecular weight of 309.84 g/mol. Its IUPAC name is 3-chloro-N-(2,3-dimethylcyclohexyl)-6-(ethylamino)pyridine-2-carboxamide.

Molecular Properties

Compound Name3-chloro-N-(2,3-dimethylcyclohexyl)-6-(ethylamino)pyridine-2-carboxamide
PubChem CID62165310
Molecular FormulaC16H24ClN3O
Molecular Weight309.84 g/mol
Exact Mass309.16
IUPAC Name3-chloro-N-(2,3-dimethylcyclohexyl)-6-(ethylamino)pyridine-2-carboxamide
SMILESCCNc1ccc(Cl)c(C(=O)NC2CCCC(C)C2C)n1
InChIInChI=1S/C16H24ClN3O/c1-4-18-14-9-8-12(17)15(20-14)16(21)19-13-7-5-6-10(2)11(13)3/h8-11,13H,4-7H2,1-3H3,(H,18,20)(H,19,21)
InChIKeyOFRAQELQTHFMOX-UHFFFAOYSA-N
XLogP3.72
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.84
LogP ≤ 53.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-N-(2,3-dimethylcyclohexyl)-2-(ethylamino)benzamide
CID 63500408
3-chloro-N-(2-cyclopentylethyl)-6-(ethylamino)pyridine-2-carboxamide
CID 62181281
2,5-dichloro-N-(2,3-dimethylcyclohexyl)benzamide
CID 43007916
N-(2,3-dimethylcyclohexyl)-4-(ethylamino)pyridine-3-carboxamide
CID 81236631
3-chloro-6-(ethylamino)-N-[(3-methylcyclopentyl)methyl]pyridine-2-carboxamide
CID 107415196
2-(3,4-dichlorophenyl)-N-(2,3-dimethylcyclohexyl)acetamide
CID 18206629
3-chloro-N-(cyclobutylmethyl)-N-ethyl-6-(ethylamino)pyridine-2-carboxamide
CID 107401299
3-chloro-6-(ethylamino)-N-[(1-methylpiperidin-3-yl)methyl]pyridine-2-carboxamide
CID 62173834
3-chloro-6-(ethylamino)-N-(2-methylpropyl)pyridine-2-carboxamide
CID 62170609
3-chloro-N-cyclobutyl-6-(methylamino)pyridine-2-carboxamide
CID 62415036
3-chloro-6-(ethylamino)-N-(4-methylpiperazin-1-yl)pyridine-2-carboxamide
CID 83024967
3-chloro-6-(ethylamino)-N-(4-methylphenyl)pyridine-2-carboxamide
CID 62165390

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-(2,3-dimethylcyclohexyl)-6-(ethylamino)pyridine-2-carboxamide?
The IUPAC name of 3-chloro-N-(2,3-dimethylcyclohexyl)-6-(ethylamino)pyridine-2-carboxamide (CID 62165310) is 3-chloro-N-(2,3-dimethylcyclohexyl)-6-(ethylamino)pyridine-2-carboxamide.
What is the SMILES notation for 3-chloro-N-(2,3-dimethylcyclohexyl)-6-(ethylamino)pyridine-2-carboxamide?
The canonical SMILES for 3-chloro-N-(2,3-dimethylcyclohexyl)-6-(ethylamino)pyridine-2-carboxamide is CCNc1ccc(Cl)c(C(=O)NC2CCCC(C)C2C)n1.
What is the InChIKey of 3-chloro-N-(2,3-dimethylcyclohexyl)-6-(ethylamino)pyridine-2-carboxamide?
The InChIKey is OFRAQELQTHFMOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24ClN3O/c1-4-18-14-9-8-12(17)15(20-14)16(21)19-13-7-5-6-10(2)11(13)3/h8-11,13H,4-7H2,1-3H3,(H,18,20)(H,19,21).
What are the key properties of 3-chloro-N-(2,3-dimethylcyclohexyl)-6-(ethylamino)pyridine-2-carboxamide?
3-chloro-N-(2,3-dimethylcyclohexyl)-6-(ethylamino)pyridine-2-carboxamide has a molecular weight of 309.84 g/mol, XLogP of 3.72, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-(2,3-dimethylcyclohexyl)-6-(ethylamino)pyridine-2-carboxamide is sourced from PubChem (CID 62165310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).