2-(phenoxymethyl)-7,8-dihydro-6H-1,6-naphthyridin-5-one

C15H14N2O2 — CID 90645513

IUPAC2-(phenoxymethyl)-7,8-dihydro-6H-1,6-naphthyridin-5-one
SMILESO=C1NCCc2nc(COc3ccccc3)ccc21
InChIInChI=1S/C15H14N2O2/c18-15-13-7-6-11(17-14(13)8-9-16-15)10-19-12-4-2-1-3-5-12/h1-7H,8-10H2,(H,16,18)
InChIKeyPHEFWHNKDLACLS-UHFFFAOYSA-N
MW254.29 g/mol
LogP1.95
Rot. Bonds3

About 2-(phenoxymethyl)-7,8-dihydro-6H-1,6-naphthyridin-5-one

2-(phenoxymethyl)-7,8-dihydro-6H-1,6-naphthyridin-5-one (PubChem CID 90645513) has the molecular formula C15H14N2O2 and a molecular weight of 254.29 g/mol. Its IUPAC name is 2-(phenoxymethyl)-7,8-dihydro-6H-1,6-naphthyridin-5-one.

Molecular Properties

Compound Name2-(phenoxymethyl)-7,8-dihydro-6H-1,6-naphthyridin-5-one
PubChem CID90645513
Molecular FormulaC15H14N2O2
Molecular Weight254.29 g/mol
Exact Mass254.11
IUPAC Name2-(phenoxymethyl)-7,8-dihydro-6H-1,6-naphthyridin-5-one
SMILESO=C1NCCc2nc(COc3ccccc3)ccc21
InChIInChI=1S/C15H14N2O2/c18-15-13-7-6-11(17-14(13)8-9-16-15)10-19-12-4-2-1-3-5-12/h1-7H,8-10H2,(H,16,18)
InChIKeyPHEFWHNKDLACLS-UHFFFAOYSA-N
XLogP1.95
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(phenoxymethyl)-7,8-dihydro-6H-1,6-naphthyridin-5-one with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(phenoxymethyl)-7,8-dihydro-6H-1,6-naphthyridin-5-one?
The IUPAC name of 2-(phenoxymethyl)-7,8-dihydro-6H-1,6-naphthyridin-5-one (CID 90645513) is 2-(phenoxymethyl)-7,8-dihydro-6H-1,6-naphthyridin-5-one.
What is the SMILES notation for 2-(phenoxymethyl)-7,8-dihydro-6H-1,6-naphthyridin-5-one?
The canonical SMILES for 2-(phenoxymethyl)-7,8-dihydro-6H-1,6-naphthyridin-5-one is O=C1NCCc2nc(COc3ccccc3)ccc21.
What is the InChIKey of 2-(phenoxymethyl)-7,8-dihydro-6H-1,6-naphthyridin-5-one?
The InChIKey is PHEFWHNKDLACLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O2/c18-15-13-7-6-11(17-14(13)8-9-16-15)10-19-12-4-2-1-3-5-12/h1-7H,8-10H2,(H,16,18).
What are the key properties of 2-(phenoxymethyl)-7,8-dihydro-6H-1,6-naphthyridin-5-one?
2-(phenoxymethyl)-7,8-dihydro-6H-1,6-naphthyridin-5-one has a molecular weight of 254.29 g/mol, XLogP of 1.95, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(phenoxymethyl)-7,8-dihydro-6H-1,6-naphthyridin-5-one is sourced from PubChem (CID 90645513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).