3-amino-N-(5-carbamoyl-2-fluorophenyl)pyridine-2-carboxamide

C13H11FN4O2 — CID 104741270

IUPAC3-amino-N-(5-carbamoyl-2-fluorophenyl)pyridine-2-carboxamide
SMILESNC(=O)c1ccc(F)c(NC(=O)c2ncccc2N)c1
InChIInChI=1S/C13H11FN4O2/c14-8-4-3-7(12(16)19)6-10(8)18-13(20)11-9(15)2-1-5-17-11/h1-6H,15H2,(H2,16,19)(H,18,20)
InChIKeyVLZIBOFAHZFPTC-UHFFFAOYSA-N
MW274.25 g/mol
LogP1.15
Rot. Bonds3

About 3-amino-N-(5-carbamoyl-2-fluorophenyl)pyridine-2-carboxamide

3-amino-N-(5-carbamoyl-2-fluorophenyl)pyridine-2-carboxamide (PubChem CID 104741270) has the molecular formula C13H11FN4O2 and a molecular weight of 274.25 g/mol. Its IUPAC name is 3-amino-N-(5-carbamoyl-2-fluorophenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-(5-carbamoyl-2-fluorophenyl)pyridine-2-carboxamide
PubChem CID104741270
Molecular FormulaC13H11FN4O2
Molecular Weight274.25 g/mol
Exact Mass274.09
IUPAC Name3-amino-N-(5-carbamoyl-2-fluorophenyl)pyridine-2-carboxamide
SMILESNC(=O)c1ccc(F)c(NC(=O)c2ncccc2N)c1
InChIInChI=1S/C13H11FN4O2/c14-8-4-3-7(12(16)19)6-10(8)18-13(20)11-9(15)2-1-5-17-11/h1-6H,15H2,(H2,16,19)(H,18,20)
InChIKeyVLZIBOFAHZFPTC-UHFFFAOYSA-N
XLogP1.15
TPSA111.10 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.25
LogP ≤ 51.15
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

3-[(3-aminopyridine-2-carbonyl)amino]-4-fluorobenzoic acid
CID 104741384
N-(3-acetamido-4-fluorophenyl)-3-aminopyridine-2-carboxamide
CID 104741465
3-amino-N-(3-fluoro-4-pyridinyl)pyridine-2-carboxamide
CID 107594913
3-amino-N-(4-chloro-2-iodophenyl)pyridine-2-carboxamide
CID 107625379
3-amino-N-(2-bromo-5-chlorophenyl)pyridine-2-carboxamide
CID 113447794
2-[(3-aminopyridine-2-carbonyl)amino]-4-chlorobenzoic acid
CID 104741854
3-amino-N-[2-methyl-4-(methylcarbamoyl)phenyl]pyridine-2-carboxamide
CID 104741149
N-(5-bromo-2-fluorophenyl)-3-hydroxypyridine-2-carboxamide
CID 54861387
3-[(3-aminopyridine-2-carbonyl)amino]benzoic acid
CID 104741844
3-amino-N-(6-chloroquinolin-8-yl)pyridine-2-carboxamide
CID 104741160
3-amino-N-[4-(carbamoylamino)phenyl]pyridine-2-carboxamide
CID 104741358
2-[(3-aminopyridine-2-carbonyl)amino]benzoic acid
CID 104741859

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(5-carbamoyl-2-fluorophenyl)pyridine-2-carboxamide?
The IUPAC name of 3-amino-N-(5-carbamoyl-2-fluorophenyl)pyridine-2-carboxamide (CID 104741270) is 3-amino-N-(5-carbamoyl-2-fluorophenyl)pyridine-2-carboxamide.
What is the SMILES notation for 3-amino-N-(5-carbamoyl-2-fluorophenyl)pyridine-2-carboxamide?
The canonical SMILES for 3-amino-N-(5-carbamoyl-2-fluorophenyl)pyridine-2-carboxamide is NC(=O)c1ccc(F)c(NC(=O)c2ncccc2N)c1.
What is the InChIKey of 3-amino-N-(5-carbamoyl-2-fluorophenyl)pyridine-2-carboxamide?
The InChIKey is VLZIBOFAHZFPTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11FN4O2/c14-8-4-3-7(12(16)19)6-10(8)18-13(20)11-9(15)2-1-5-17-11/h1-6H,15H2,(H2,16,19)(H,18,20).
What are the key properties of 3-amino-N-(5-carbamoyl-2-fluorophenyl)pyridine-2-carboxamide?
3-amino-N-(5-carbamoyl-2-fluorophenyl)pyridine-2-carboxamide has a molecular weight of 274.25 g/mol, XLogP of 1.15, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(5-carbamoyl-2-fluorophenyl)pyridine-2-carboxamide is sourced from PubChem (CID 104741270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).