3-chloro-N-(2-fluoro-4-methylphenyl)-6-(methylamino)pyridine-2-carboxamide

C14H13ClFN3O — CID 62186223

IUPAC3-chloro-N-(2-fluoro-4-methylphenyl)-6-(methylamino)pyridine-2-carboxamide
SMILESCNc1ccc(Cl)c(C(=O)Nc2ccc(C)cc2F)n1
InChIInChI=1S/C14H13ClFN3O/c1-8-3-5-11(10(16)7-8)18-14(20)13-9(15)4-6-12(17-2)19-13/h3-7H,1-2H3,(H,17,19)(H,18,20)
InChIKeyCXHNIVWKFRHSOB-UHFFFAOYSA-N
MW293.73 g/mol
LogP3.48
Rot. Bonds3

About 3-chloro-N-(2-fluoro-4-methylphenyl)-6-(methylamino)pyridine-2-carboxamide

3-chloro-N-(2-fluoro-4-methylphenyl)-6-(methylamino)pyridine-2-carboxamide (PubChem CID 62186223) has the molecular formula C14H13ClFN3O and a molecular weight of 293.73 g/mol. Its IUPAC name is 3-chloro-N-(2-fluoro-4-methylphenyl)-6-(methylamino)pyridine-2-carboxamide.

Molecular Properties

Compound Name3-chloro-N-(2-fluoro-4-methylphenyl)-6-(methylamino)pyridine-2-carboxamide
PubChem CID62186223
Molecular FormulaC14H13ClFN3O
Molecular Weight293.73 g/mol
Exact Mass293.07
IUPAC Name3-chloro-N-(2-fluoro-4-methylphenyl)-6-(methylamino)pyridine-2-carboxamide
SMILESCNc1ccc(Cl)c(C(=O)Nc2ccc(C)cc2F)n1
InChIInChI=1S/C14H13ClFN3O/c1-8-3-5-11(10(16)7-8)18-14(20)13-9(15)4-6-12(17-2)19-13/h3-7H,1-2H3,(H,17,19)(H,18,20)
InChIKeyCXHNIVWKFRHSOB-UHFFFAOYSA-N
XLogP3.48
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.73
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-chloro-N-(2-fluoro-5-methylphenyl)-6-(methylamino)pyridine-2-carboxamide
CID 62165789
3-chloro-N-(2-chloro-5-methylphenyl)-6-(ethylamino)pyridine-2-carboxamide
CID 107631276
3-chloro-6-(methylamino)-N-(5-methyl-3-pyridinyl)pyridine-2-carboxamide
CID 107586618
3-chloro-N-(3,5-dichlorophenyl)-6-(methylamino)pyridine-2-carboxamide
CID 62173294
N-(4-chloro-2-fluorophenyl)-2-fluoro-5-methylbenzamide
CID 55083427
3-chloro-N-(3-fluoro-4-methoxyphenyl)-6-(methylamino)pyridine-2-carboxamide
CID 62169174
2-chloro-N-(2-fluorophenyl)-5-methylbenzamide
CID 122630269
3-chloro-N-(2,6-dichloro-3-methylphenyl)-6-(methylamino)pyridine-2-carboxamide
CID 62186267
3-bromo-4-chloro-N-(2-fluoro-4-methylphenyl)benzamide
CID 103841501
N-(2-fluoro-4-methylphenyl)-5-(methylamino)pyridine-2-carboxamide
CID 104639628
3-chloro-6-(ethylamino)-N-(4-fluoro-2-methylphenyl)pyridine-2-carboxamide
CID 62165196
N-(5-bromo-2-methoxyphenyl)-3-chloro-6-(methylamino)pyridine-2-carboxamide
CID 62177125

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-(2-fluoro-4-methylphenyl)-6-(methylamino)pyridine-2-carboxamide?
The IUPAC name of 3-chloro-N-(2-fluoro-4-methylphenyl)-6-(methylamino)pyridine-2-carboxamide (CID 62186223) is 3-chloro-N-(2-fluoro-4-methylphenyl)-6-(methylamino)pyridine-2-carboxamide.
What is the SMILES notation for 3-chloro-N-(2-fluoro-4-methylphenyl)-6-(methylamino)pyridine-2-carboxamide?
The canonical SMILES for 3-chloro-N-(2-fluoro-4-methylphenyl)-6-(methylamino)pyridine-2-carboxamide is CNc1ccc(Cl)c(C(=O)Nc2ccc(C)cc2F)n1.
What is the InChIKey of 3-chloro-N-(2-fluoro-4-methylphenyl)-6-(methylamino)pyridine-2-carboxamide?
The InChIKey is CXHNIVWKFRHSOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClFN3O/c1-8-3-5-11(10(16)7-8)18-14(20)13-9(15)4-6-12(17-2)19-13/h3-7H,1-2H3,(H,17,19)(H,18,20).
What are the key properties of 3-chloro-N-(2-fluoro-4-methylphenyl)-6-(methylamino)pyridine-2-carboxamide?
3-chloro-N-(2-fluoro-4-methylphenyl)-6-(methylamino)pyridine-2-carboxamide has a molecular weight of 293.73 g/mol, XLogP of 3.48, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-(2-fluoro-4-methylphenyl)-6-(methylamino)pyridine-2-carboxamide is sourced from PubChem (CID 62186223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).