4-[(2-fluorophenyl)carbamoylamino]pyridine-2-carboxylic acid

C13H10FN3O3 — CID 63651767

IUPAC4-[(2-fluorophenyl)carbamoylamino]pyridine-2-carboxylic acid
SMILESO=C(Nc1ccnc(C(=O)O)c1)Nc1ccccc1F
InChIInChI=1S/C13H10FN3O3/c14-9-3-1-2-4-10(9)17-13(20)16-8-5-6-15-11(7-8)12(18)19/h1-7H,(H,18,19)(H2,15,16,17,20)
InChIKeyKRALNAPPPPWLNV-UHFFFAOYSA-N
MW275.24 g/mol
LogP2.56
Rot. Bonds3

About 4-[(2-fluorophenyl)carbamoylamino]pyridine-2-carboxylic acid

4-[(2-fluorophenyl)carbamoylamino]pyridine-2-carboxylic acid (PubChem CID 63651767) has the molecular formula C13H10FN3O3 and a molecular weight of 275.24 g/mol. Its IUPAC name is 4-[(2-fluorophenyl)carbamoylamino]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name4-[(2-fluorophenyl)carbamoylamino]pyridine-2-carboxylic acid
PubChem CID63651767
Molecular FormulaC13H10FN3O3
Molecular Weight275.24 g/mol
Exact Mass275.07
IUPAC Name4-[(2-fluorophenyl)carbamoylamino]pyridine-2-carboxylic acid
SMILESO=C(Nc1ccnc(C(=O)O)c1)Nc1ccccc1F
InChIInChI=1S/C13H10FN3O3/c14-9-3-1-2-4-10(9)17-13(20)16-8-5-6-15-11(7-8)12(18)19/h1-7H,(H,18,19)(H2,15,16,17,20)
InChIKeyKRALNAPPPPWLNV-UHFFFAOYSA-N
XLogP2.56
TPSA91.32 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.24
LogP ≤ 52.56
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-fluorophenyl)-4-hydrazinylpyridine-2-carboxamide
CID 62249933
4-[[2-(2-fluorophenyl)sulfanylacetyl]amino]pyridine-2-carboxylic acid
CID 63651197
N-(2,6-difluorophenyl)-4-(2-fluoroanilino)pyridine-2-carboxamide
CID 109220720
N-(2-fluorophenyl)-4-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide
CID 109220614
4-(5-chloro-2-fluoroanilino)pyridine-2-carboxylic acid
CID 43438570
6-[(2-fluorophenyl)carbamoylamino]pyridine-2-carboxylic acid
CID 63643427
N-(2-fluorophenyl)-4-(propylamino)pyridine-2-carboxamide
CID 62166215
N-(2-bromophenyl)-4-(2-fluoroanilino)pyridine-2-carboxamide
CID 109220697
4-[(4-cyanophenyl)carbamoylamino]pyridine-2-carboxylic acid
CID 63650036
4-[(3-chloro-4-methylphenyl)carbamoylamino]pyridine-2-carboxylic acid
CID 63651885
4-(3-chloro-4-methylanilino)-N-(2-fluorophenyl)pyridine-2-carboxamide
CID 109220598
N-(2,6-dichlorophenyl)-4-(2-fluoroanilino)pyridine-2-carboxamide
CID 109220710

Frequently Asked Questions

What is the IUPAC name of 4-[(2-fluorophenyl)carbamoylamino]pyridine-2-carboxylic acid?
The IUPAC name of 4-[(2-fluorophenyl)carbamoylamino]pyridine-2-carboxylic acid (CID 63651767) is 4-[(2-fluorophenyl)carbamoylamino]pyridine-2-carboxylic acid.
What is the SMILES notation for 4-[(2-fluorophenyl)carbamoylamino]pyridine-2-carboxylic acid?
The canonical SMILES for 4-[(2-fluorophenyl)carbamoylamino]pyridine-2-carboxylic acid is O=C(Nc1ccnc(C(=O)O)c1)Nc1ccccc1F.
What is the InChIKey of 4-[(2-fluorophenyl)carbamoylamino]pyridine-2-carboxylic acid?
The InChIKey is KRALNAPPPPWLNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10FN3O3/c14-9-3-1-2-4-10(9)17-13(20)16-8-5-6-15-11(7-8)12(18)19/h1-7H,(H,18,19)(H2,15,16,17,20).
What are the key properties of 4-[(2-fluorophenyl)carbamoylamino]pyridine-2-carboxylic acid?
4-[(2-fluorophenyl)carbamoylamino]pyridine-2-carboxylic acid has a molecular weight of 275.24 g/mol, XLogP of 2.56, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-fluorophenyl)carbamoylamino]pyridine-2-carboxylic acid is sourced from PubChem (CID 63651767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).