2-amino-6-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide

C13H10F3N3O — CID 68563982

IUPAC2-amino-6-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide
SMILESNC(=O)c1ccc(-c2ccccc2C(F)(F)F)nc1N
InChIInChI=1S/C13H10F3N3O/c14-13(15,16)9-4-2-1-3-7(9)10-6-5-8(12(18)20)11(17)19-10/h1-6H,(H2,17,19)(H2,18,20)
InChIKeyDATHNTFKZLSFBR-UHFFFAOYSA-N
MW281.24 g/mol
LogP2.45
Rot. Bonds2

About 2-amino-6-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide

2-amino-6-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide (PubChem CID 68563982) has the molecular formula C13H10F3N3O and a molecular weight of 281.24 g/mol. Its IUPAC name is 2-amino-6-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-amino-6-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide
PubChem CID68563982
Molecular FormulaC13H10F3N3O
Molecular Weight281.24 g/mol
Exact Mass281.08
IUPAC Name2-amino-6-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide
SMILESNC(=O)c1ccc(-c2ccccc2C(F)(F)F)nc1N
InChIInChI=1S/C13H10F3N3O/c14-13(15,16)9-4-2-1-3-7(9)10-6-5-8(12(18)20)11(17)19-10/h1-6H,(H2,17,19)(H2,18,20)
InChIKeyDATHNTFKZLSFBR-UHFFFAOYSA-N
XLogP2.45
TPSA82.00 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.24
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

Vx-702
CID 10341154
2-Aminoquinoline-3-carboxamide
CID 5200228
3-Acyl-2,6-diaminopyridine deriv. 2c
CID 5330817
2-(4-Ethyl-phenylamino)-4,6-dimethyl-nicotinamide
CID 712047
2-Amino-4,6-dimethylpyridine-3-carboxamide
CID 252216
3-Acyl-2,6-diaminopyridine deriv. 3a
CID 5330840
3-Acyl-2,6-diaminopyridine deriv. 3b
CID 5330841
(2,6-Diaminopyridin-3-yl)(phenyl)methanone
CID 5330842
2-(4-Fluoro-phenylamino)-4,6-dimethyl-nicotinamide
CID 686880
N-(2-fluorophenyl)-2-methyl-6-(trifluoromethyl)nicotinamide
CID 2795899
2-Butylamino-6-phenyl-4-trifluoromethyl-nicotinamide
CID 1904911
2-[(Anilinocarbonyl)amino]-4,6-dimethylnicotinamide
CID 4362481

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide?
The IUPAC name of 2-amino-6-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide (CID 68563982) is 2-amino-6-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide.
What is the SMILES notation for 2-amino-6-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide?
The canonical SMILES for 2-amino-6-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide is NC(=O)c1ccc(-c2ccccc2C(F)(F)F)nc1N.
What is the InChIKey of 2-amino-6-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide?
The InChIKey is DATHNTFKZLSFBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10F3N3O/c14-13(15,16)9-4-2-1-3-7(9)10-6-5-8(12(18)20)11(17)19-10/h1-6H,(H2,17,19)(H2,18,20).
What are the key properties of 2-amino-6-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide?
2-amino-6-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide has a molecular weight of 281.24 g/mol, XLogP of 2.45, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide is sourced from PubChem (CID 68563982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).