4-amino-N-(5-fluoro-2-methylphenyl)pyridine-2-carboxamide

C13H12FN3O — CID 62155744

IUPAC4-amino-N-(5-fluoro-2-methylphenyl)pyridine-2-carboxamide
SMILESCc1ccc(F)cc1NC(=O)c1cc(N)ccn1
InChIInChI=1S/C13H12FN3O/c1-8-2-3-9(14)6-11(8)17-13(18)12-7-10(15)4-5-16-12/h2-7H,1H3,(H2,15,16)(H,17,18)
InChIKeyRPUKGKYWWAKZTK-UHFFFAOYSA-N
MW245.26 g/mol
LogP2.36
Rot. Bonds2

About 4-amino-N-(5-fluoro-2-methylphenyl)pyridine-2-carboxamide

4-amino-N-(5-fluoro-2-methylphenyl)pyridine-2-carboxamide (PubChem CID 62155744) has the molecular formula C13H12FN3O and a molecular weight of 245.26 g/mol. Its IUPAC name is 4-amino-N-(5-fluoro-2-methylphenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-amino-N-(5-fluoro-2-methylphenyl)pyridine-2-carboxamide
PubChem CID62155744
Molecular FormulaC13H12FN3O
Molecular Weight245.26 g/mol
Exact Mass245.10
IUPAC Name4-amino-N-(5-fluoro-2-methylphenyl)pyridine-2-carboxamide
SMILESCc1ccc(F)cc1NC(=O)c1cc(N)ccn1
InChIInChI=1S/C13H12FN3O/c1-8-2-3-9(14)6-11(8)17-13(18)12-7-10(15)4-5-16-12/h2-7H,1H3,(H2,15,16)(H,17,18)
InChIKeyRPUKGKYWWAKZTK-UHFFFAOYSA-N
XLogP2.36
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.26
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(5-fluoro-2-methylphenyl)-1,3-thiazole-4-carboxamide
CID 55116155
4-amino-N-(2,6-difluoro-3-methylphenyl)pyridine-2-carboxamide
CID 82820376
4-amino-N-(2,3-dimethylphenyl)pyridine-2-carboxamide
CID 62156095
4-amino-N-(2-fluorophenyl)pyridine-2-carboxamide
CID 62155055
4-amino-N-(3,5-difluorophenyl)pyridine-2-carboxamide
CID 55041778
2-N-(2,4-difluorophenyl)-4-N-(2,5-dimethylphenyl)pyridine-2,4-dicarboxamide
CID 109091819
4-amino-N-(2,6-dichloro-4-fluorophenyl)pyridine-2-carboxamide
CID 83079445
4-amino-N-(2-bromo-4-methylphenyl)pyridine-2-carboxamide
CID 62153202
5-amino-2,3-dichloro-N-(5-fluoro-2-methylphenyl)benzamide
CID 107183212
2-chloro-N-(5-fluoro-2-methylphenyl)pyridine-3-carboxamide
CID 9097781
5-amino-N-(5-fluoro-2-methylphenyl)-1H-indazole-3-carboxamide
CID 60904758
5-(3-aminoprop-1-ynyl)-N-(5-fluoro-2-methylphenyl)pyridine-2-carboxamide
CID 62960498

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(5-fluoro-2-methylphenyl)pyridine-2-carboxamide?
The IUPAC name of 4-amino-N-(5-fluoro-2-methylphenyl)pyridine-2-carboxamide (CID 62155744) is 4-amino-N-(5-fluoro-2-methylphenyl)pyridine-2-carboxamide.
What is the SMILES notation for 4-amino-N-(5-fluoro-2-methylphenyl)pyridine-2-carboxamide?
The canonical SMILES for 4-amino-N-(5-fluoro-2-methylphenyl)pyridine-2-carboxamide is Cc1ccc(F)cc1NC(=O)c1cc(N)ccn1.
What is the InChIKey of 4-amino-N-(5-fluoro-2-methylphenyl)pyridine-2-carboxamide?
The InChIKey is RPUKGKYWWAKZTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12FN3O/c1-8-2-3-9(14)6-11(8)17-13(18)12-7-10(15)4-5-16-12/h2-7H,1H3,(H2,15,16)(H,17,18).
What are the key properties of 4-amino-N-(5-fluoro-2-methylphenyl)pyridine-2-carboxamide?
4-amino-N-(5-fluoro-2-methylphenyl)pyridine-2-carboxamide has a molecular weight of 245.26 g/mol, XLogP of 2.36, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(5-fluoro-2-methylphenyl)pyridine-2-carboxamide is sourced from PubChem (CID 62155744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).