2-[(4-fluorophenoxy)methyl]-3H-1,7-naphthyridin-4-one

C15H11FN2O2 — CID 159425716

IUPAC2-[(4-fluorophenoxy)methyl]-3H-1,7-naphthyridin-4-one
SMILESO=C1CC(COc2ccc(F)cc2)=Nc2cnccc21
InChIInChI=1S/C15H11FN2O2/c16-10-1-3-12(4-2-10)20-9-11-7-15(19)13-5-6-17-8-14(13)18-11/h1-6,8H,7,9H2
InChIKeyLQIABMRGHUYHOP-UHFFFAOYSA-N
MW270.26 g/mol
LogP2.96
Rot. Bonds3

About 2-[(4-fluorophenoxy)methyl]-3H-1,7-naphthyridin-4-one

2-[(4-fluorophenoxy)methyl]-3H-1,7-naphthyridin-4-one (PubChem CID 159425716) has the molecular formula C15H11FN2O2 and a molecular weight of 270.26 g/mol. Its IUPAC name is 2-[(4-fluorophenoxy)methyl]-3H-1,7-naphthyridin-4-one.

Molecular Properties

Compound Name2-[(4-fluorophenoxy)methyl]-3H-1,7-naphthyridin-4-one
PubChem CID159425716
Molecular FormulaC15H11FN2O2
Molecular Weight270.26 g/mol
Exact Mass270.08
IUPAC Name2-[(4-fluorophenoxy)methyl]-3H-1,7-naphthyridin-4-one
SMILESO=C1CC(COc2ccc(F)cc2)=Nc2cnccc21
InChIInChI=1S/C15H11FN2O2/c16-10-1-3-12(4-2-10)20-9-11-7-15(19)13-5-6-17-8-14(13)18-11/h1-6,8H,7,9H2
InChIKeyLQIABMRGHUYHOP-UHFFFAOYSA-N
XLogP2.96
TPSA51.55 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.26
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-[(4-fluorophenoxy)methyl]-3H-1,7-naphthyridin-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[(4-butylphenoxy)methyl]-3H-1,7-naphthyridin-4-one
CID 149037989
2-[(2-pyridin-4-ylphenoxy)methyl]-3H-1,7-naphthyridin-4-one
CID 159615706
4-[(4-fluorophenoxy)methyl]pyridin-3-amine
CID 105472082
2-[(3-chloro-4-fluorophenoxy)methyl]-8-pyrazin-2-yl-3H-1,7-naphthyridin-4-one
CID 158646066
6-[(4-fluorophenoxy)methyl]-3-(3-fluoro-4-pyridinyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
CID 141409625
3-[[4-(pyridin-3-ylmethoxy)phenoxy]methyl]pyridine
CID 91147542
1H-1,7-naphthyridine-2,4-dione
CID 125415230
6-[(4-fluorophenoxy)methyl]pyridine-3-carbaldehyde
CID 59255367
3-[2-[(4-fluorophenoxy)methyl]-1,3-thiazol-5-yl]propanoic acid
CID 82423049
5-[(4-fluorophenoxy)methyl]pyridine-3-carboxylic acid
CID 117212713
5-chloro-2-[(4-fluorophenoxy)methyl]-1-methylimidazole
CID 60667995
N-[4-(4-fluorophenoxy)butyl]-4-(pyridin-3-ylmethoxy)benzamide
CID 32645882

Frequently Asked Questions

What is the IUPAC name of 2-[(4-fluorophenoxy)methyl]-3H-1,7-naphthyridin-4-one?
The IUPAC name of 2-[(4-fluorophenoxy)methyl]-3H-1,7-naphthyridin-4-one (CID 159425716) is 2-[(4-fluorophenoxy)methyl]-3H-1,7-naphthyridin-4-one.
What is the SMILES notation for 2-[(4-fluorophenoxy)methyl]-3H-1,7-naphthyridin-4-one?
The canonical SMILES for 2-[(4-fluorophenoxy)methyl]-3H-1,7-naphthyridin-4-one is O=C1CC(COc2ccc(F)cc2)=Nc2cnccc21.
What is the InChIKey of 2-[(4-fluorophenoxy)methyl]-3H-1,7-naphthyridin-4-one?
The InChIKey is LQIABMRGHUYHOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11FN2O2/c16-10-1-3-12(4-2-10)20-9-11-7-15(19)13-5-6-17-8-14(13)18-11/h1-6,8H,7,9H2.
What are the key properties of 2-[(4-fluorophenoxy)methyl]-3H-1,7-naphthyridin-4-one?
2-[(4-fluorophenoxy)methyl]-3H-1,7-naphthyridin-4-one has a molecular weight of 270.26 g/mol, XLogP of 2.96, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-fluorophenoxy)methyl]-3H-1,7-naphthyridin-4-one is sourced from PubChem (CID 159425716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).