2-amino-N-(2,3-difluorophenyl)pyridine-4-carboxamide

C12H9F2N3O — CID 62161331

IUPAC2-amino-N-(2,3-difluorophenyl)pyridine-4-carboxamide
SMILESNc1cc(C(=O)Nc2cccc(F)c2F)ccn1
InChIInChI=1S/C12H9F2N3O/c13-8-2-1-3-9(11(8)14)17-12(18)7-4-5-16-10(15)6-7/h1-6H,(H2,15,16)(H,17,18)
InChIKeyIUSCJBZTNJAIEV-UHFFFAOYSA-N
MW249.22 g/mol
LogP2.19
Rot. Bonds2

About 2-amino-N-(2,3-difluorophenyl)pyridine-4-carboxamide

2-amino-N-(2,3-difluorophenyl)pyridine-4-carboxamide (PubChem CID 62161331) has the molecular formula C12H9F2N3O and a molecular weight of 249.22 g/mol. Its IUPAC name is 2-amino-N-(2,3-difluorophenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-N-(2,3-difluorophenyl)pyridine-4-carboxamide
PubChem CID62161331
Molecular FormulaC12H9F2N3O
Molecular Weight249.22 g/mol
Exact Mass249.07
IUPAC Name2-amino-N-(2,3-difluorophenyl)pyridine-4-carboxamide
SMILESNc1cc(C(=O)Nc2cccc(F)c2F)ccn1
InChIInChI=1S/C12H9F2N3O/c13-8-2-1-3-9(11(8)14)17-12(18)7-4-5-16-10(15)6-7/h1-6H,(H2,15,16)(H,17,18)
InChIKeyIUSCJBZTNJAIEV-UHFFFAOYSA-N
XLogP2.19
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.22
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(2,3,4-trifluorophenyl)pyridine-4-carboxamide
CID 62151990
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CID 55041638
N-(2,3-difluorophenyl)pyridine-4-carboxamide
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N-(2,3-difluorophenyl)-2-(ethylamino)pyridine-4-carboxamide
CID 62179197
2-amino-N-(4-bromo-2-fluorophenyl)pyridine-4-carboxamide
CID 62151121
3-[(2,3-difluorophenyl)carbamoyl]benzoic acid
CID 61076302
4-amino-N-(2,3-difluorophenyl)-3-methoxybenzamide
CID 104782496
N-(2,3-difluorophenyl)benzamide
CID 139202270
2-amino-N-(2,6-dibromophenyl)pyridine-4-carboxamide
CID 107603227
3-bromo-N-(2,3-difluorophenyl)-4-fluorobenzamide
CID 103707138
3-amino-N-(2,3-difluorophenyl)-5-fluoro-4-methylbenzamide
CID 61076065
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CID 82685570

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2,3-difluorophenyl)pyridine-4-carboxamide?
The IUPAC name of 2-amino-N-(2,3-difluorophenyl)pyridine-4-carboxamide (CID 62161331) is 2-amino-N-(2,3-difluorophenyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-amino-N-(2,3-difluorophenyl)pyridine-4-carboxamide?
The canonical SMILES for 2-amino-N-(2,3-difluorophenyl)pyridine-4-carboxamide is Nc1cc(C(=O)Nc2cccc(F)c2F)ccn1.
What is the InChIKey of 2-amino-N-(2,3-difluorophenyl)pyridine-4-carboxamide?
The InChIKey is IUSCJBZTNJAIEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9F2N3O/c13-8-2-1-3-9(11(8)14)17-12(18)7-4-5-16-10(15)6-7/h1-6H,(H2,15,16)(H,17,18).
What are the key properties of 2-amino-N-(2,3-difluorophenyl)pyridine-4-carboxamide?
2-amino-N-(2,3-difluorophenyl)pyridine-4-carboxamide has a molecular weight of 249.22 g/mol, XLogP of 2.19, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2,3-difluorophenyl)pyridine-4-carboxamide is sourced from PubChem (CID 62161331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).