1-(4-fluorophenyl)-4-oxo-N-(pyridin-3-ylmethyl)-1,8-naphthyridine-3-carboxamide

C21H15FN4O2 — CID 70011453

IUPAC1-(4-fluorophenyl)-4-oxo-N-(pyridin-3-ylmethyl)-1,8-naphthyridine-3-carboxamide
SMILESO=C(NCc1cccnc1)c1cn(-c2ccc(F)cc2)c2ncccc2c1=O
InChIInChI=1S/C21H15FN4O2/c22-15-5-7-16(8-6-15)26-13-18(19(27)17-4-2-10-24-20(17)26)21(28)25-12-14-3-1-9-23-11-14/h1-11,13H,12H2,(H,25,28)
InChIKeyOUKGENYUHVOFGV-UHFFFAOYSA-N
MW374.38 g/mol
LogP2.85
Rot. Bonds4

About 1-(4-fluorophenyl)-4-oxo-N-(pyridin-3-ylmethyl)-1,8-naphthyridine-3-carboxamide

1-(4-fluorophenyl)-4-oxo-N-(pyridin-3-ylmethyl)-1,8-naphthyridine-3-carboxamide (PubChem CID 70011453) has the molecular formula C21H15FN4O2 and a molecular weight of 374.38 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-4-oxo-N-(pyridin-3-ylmethyl)-1,8-naphthyridine-3-carboxamide.

Molecular Properties

Compound Name1-(4-fluorophenyl)-4-oxo-N-(pyridin-3-ylmethyl)-1,8-naphthyridine-3-carboxamide
PubChem CID70011453
Molecular FormulaC21H15FN4O2
Molecular Weight374.38 g/mol
Exact Mass374.12
IUPAC Name1-(4-fluorophenyl)-4-oxo-N-(pyridin-3-ylmethyl)-1,8-naphthyridine-3-carboxamide
SMILESO=C(NCc1cccnc1)c1cn(-c2ccc(F)cc2)c2ncccc2c1=O
InChIInChI=1S/C21H15FN4O2/c22-15-5-7-16(8-6-15)26-13-18(19(27)17-4-2-10-24-20(17)26)21(28)25-12-14-3-1-9-23-11-14/h1-11,13H,12H2,(H,25,28)
InChIKeyOUKGENYUHVOFGV-UHFFFAOYSA-N
XLogP2.85
TPSA76.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.38
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(4-fluorophenyl)-4-oxo-N-pyridin-4-yl-1,8-naphthyridine-3-carboxamide
CID 70012505
1-(4-fluorophenyl)-4-oxo-N-propan-2-yl-1,8-naphthyridine-3-carboxamide
CID 70011978
1-(4-fluorophenyl)-N-isoquinolin-1-yl-4-oxo-1,8-naphthyridine-3-carboxamide
CID 70011896
N-(4-carbamoylphenyl)-1-(4-fluorophenyl)-4-oxo-1,8-naphthyridine-3-carboxamide
CID 70011012
1-(4-fluorophenyl)-4-oxo-N-quinolin-2-yl-1,8-naphthyridine-3-carboxamide
CID 70012237
2-fluoro-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 107358424
2-(2,4-difluorophenyl)-1-oxo-N-(pyridin-3-ylmethyl)isoquinoline-4-carboxamide
CID 23936227
2-[(4-fluorophenyl)methoxy]-N-(pyridin-3-ylmethyl)benzamide
CID 8851794
3-cyano-1-(4-fluorophenyl)-N-(pyridin-3-ylmethyl)pyrrole-2-carboxamide
CID 5135449
ethyl 4-oxo-1-pyridin-3-yl-1,8-naphthyridine-3-carboxylate
CID 12972530
2-[(4-fluorophenyl)carbamothioylamino]-N-(pyridin-3-ylmethyl)benzamide
CID 100641344
2,3,5,6-tetrafluoro-1-N,4-N-bis(pyridin-3-ylmethyl)benzene-1,4-dicarboxamide
CID 1204787

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-4-oxo-N-(pyridin-3-ylmethyl)-1,8-naphthyridine-3-carboxamide?
The IUPAC name of 1-(4-fluorophenyl)-4-oxo-N-(pyridin-3-ylmethyl)-1,8-naphthyridine-3-carboxamide (CID 70011453) is 1-(4-fluorophenyl)-4-oxo-N-(pyridin-3-ylmethyl)-1,8-naphthyridine-3-carboxamide.
What is the SMILES notation for 1-(4-fluorophenyl)-4-oxo-N-(pyridin-3-ylmethyl)-1,8-naphthyridine-3-carboxamide?
The canonical SMILES for 1-(4-fluorophenyl)-4-oxo-N-(pyridin-3-ylmethyl)-1,8-naphthyridine-3-carboxamide is O=C(NCc1cccnc1)c1cn(-c2ccc(F)cc2)c2ncccc2c1=O.
What is the InChIKey of 1-(4-fluorophenyl)-4-oxo-N-(pyridin-3-ylmethyl)-1,8-naphthyridine-3-carboxamide?
The InChIKey is OUKGENYUHVOFGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15FN4O2/c22-15-5-7-16(8-6-15)26-13-18(19(27)17-4-2-10-24-20(17)26)21(28)25-12-14-3-1-9-23-11-14/h1-11,13H,12H2,(H,25,28).
What are the key properties of 1-(4-fluorophenyl)-4-oxo-N-(pyridin-3-ylmethyl)-1,8-naphthyridine-3-carboxamide?
1-(4-fluorophenyl)-4-oxo-N-(pyridin-3-ylmethyl)-1,8-naphthyridine-3-carboxamide has a molecular weight of 374.38 g/mol, XLogP of 2.85, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-4-oxo-N-(pyridin-3-ylmethyl)-1,8-naphthyridine-3-carboxamide is sourced from PubChem (CID 70011453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).