2-(3-fluorophenyl)-7-methyl-1H-1,8-naphthyridin-4-one

C15H11FN2O — CID 5468784

IUPAC2-(3-fluorophenyl)-7-methyl-1H-1,8-naphthyridin-4-one
SMILESCc1ccc2c(=O)cc(-c3cccc(F)c3)[nH]c2n1
InChIInChI=1S/C15H11FN2O/c1-9-5-6-12-14(19)8-13(18-15(12)17-9)10-3-2-4-11(16)7-10/h2-8H,1H3,(H,17,18,19)
InChIKeyAFJQIXFUZDUCHX-UHFFFAOYSA-N
MW254.26 g/mol
LogP3.04
Rot. Bonds1

About 2-(3-fluorophenyl)-7-methyl-1H-1,8-naphthyridin-4-one

2-(3-fluorophenyl)-7-methyl-1H-1,8-naphthyridin-4-one (PubChem CID 5468784) has the molecular formula C15H11FN2O and a molecular weight of 254.26 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-7-methyl-1H-1,8-naphthyridin-4-one.

Molecular Properties

Compound Name2-(3-fluorophenyl)-7-methyl-1H-1,8-naphthyridin-4-one
PubChem CID5468784
Molecular FormulaC15H11FN2O
Molecular Weight254.26 g/mol
Exact Mass254.09
IUPAC Name2-(3-fluorophenyl)-7-methyl-1H-1,8-naphthyridin-4-one
SMILESCc1ccc2c(=O)cc(-c3cccc(F)c3)[nH]c2n1
InChIInChI=1S/C15H11FN2O/c1-9-5-6-12-14(19)8-13(18-15(12)17-9)10-3-2-4-11(16)7-10/h2-8H,1H3,(H,17,18,19)
InChIKeyAFJQIXFUZDUCHX-UHFFFAOYSA-N
XLogP3.04
TPSA45.75 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.26
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Vx-702
CID 10341154
7-Chloro-4-hydroxy-2-phenyl-1,8-naphthyridine
CID 6105572
7-Dimethylamino-2-phenyl-[1,8]naphthyridin-4-ol
CID 10378184
7-Bromo-2-phenyl-1,8-naphthyridin-4-ol
CID 10402581
3-Acyl-2,6-diaminopyridine deriv. 2c
CID 5330817
3-Acyl-2,6-diaminopyridine deriv. 2m
CID 5330827
3-Methyl-N-(6-methyl-2-pyridinyl)benzamide
CID 966005
2-(4-Ethyl-phenylamino)-4,6-dimethyl-nicotinamide
CID 712047
N-[[(6-methyl-2-pyridinyl)amino]-oxomethyl]benzamide
CID 5093257
5,7-dimethylpyrido[2,3-d]pyrimidin-4(3H)-one
CID 135408240
Benzamide, p-amino-N-(6-methyl-2-pyridyl)-
CID 37553
N-(4,6-dimethyl-2-pyridinyl)benzamide
CID 124524

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-7-methyl-1H-1,8-naphthyridin-4-one?
The IUPAC name of 2-(3-fluorophenyl)-7-methyl-1H-1,8-naphthyridin-4-one (CID 5468784) is 2-(3-fluorophenyl)-7-methyl-1H-1,8-naphthyridin-4-one.
What is the SMILES notation for 2-(3-fluorophenyl)-7-methyl-1H-1,8-naphthyridin-4-one?
The canonical SMILES for 2-(3-fluorophenyl)-7-methyl-1H-1,8-naphthyridin-4-one is Cc1ccc2c(=O)cc(-c3cccc(F)c3)[nH]c2n1.
What is the InChIKey of 2-(3-fluorophenyl)-7-methyl-1H-1,8-naphthyridin-4-one?
The InChIKey is AFJQIXFUZDUCHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11FN2O/c1-9-5-6-12-14(19)8-13(18-15(12)17-9)10-3-2-4-11(16)7-10/h2-8H,1H3,(H,17,18,19).
What are the key properties of 2-(3-fluorophenyl)-7-methyl-1H-1,8-naphthyridin-4-one?
2-(3-fluorophenyl)-7-methyl-1H-1,8-naphthyridin-4-one has a molecular weight of 254.26 g/mol, XLogP of 3.04, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-7-methyl-1H-1,8-naphthyridin-4-one is sourced from PubChem (CID 5468784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).