7,8-dihydro-2H-1,8-naphthyridin-3-one

C8H8N2O — CID 174794414

IUPAC7,8-dihydro-2H-1,8-naphthyridin-3-one
SMILESO=C1C=C2C=CCNC2=NC1
InChIInChI=1S/C8H8N2O/c11-7-4-6-2-1-3-9-8(6)10-5-7/h1-2,4H,3,5H2,(H,9,10)
InChIKeyVFSZODBRSKQKSW-UHFFFAOYSA-N
MW148.16 g/mol
LogP0.05
Rot. Bonds

About 7,8-dihydro-2H-1,8-naphthyridin-3-one

7,8-dihydro-2H-1,8-naphthyridin-3-one (PubChem CID 174794414) has the molecular formula C8H8N2O and a molecular weight of 148.16 g/mol. Its IUPAC name is 7,8-dihydro-2H-1,8-naphthyridin-3-one.

Molecular Properties

Compound Name7,8-dihydro-2H-1,8-naphthyridin-3-one
PubChem CID174794414
Molecular FormulaC8H8N2O
Molecular Weight148.16 g/mol
Exact Mass148.06
IUPAC Name7,8-dihydro-2H-1,8-naphthyridin-3-one
SMILESO=C1C=C2C=CCNC2=NC1
InChIInChI=1S/C8H8N2O/c11-7-4-6-2-1-3-9-8(6)10-5-7/h1-2,4H,3,5H2,(H,9,10)
InChIKeyVFSZODBRSKQKSW-UHFFFAOYSA-N
XLogP0.05
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.16
LogP ≤ 50.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 7,8-dihydro-2H-1,8-naphthyridin-3-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 7,8-dihydro-2H-1,8-naphthyridin-3-one?
The IUPAC name of 7,8-dihydro-2H-1,8-naphthyridin-3-one (CID 174794414) is 7,8-dihydro-2H-1,8-naphthyridin-3-one.
What is the SMILES notation for 7,8-dihydro-2H-1,8-naphthyridin-3-one?
The canonical SMILES for 7,8-dihydro-2H-1,8-naphthyridin-3-one is O=C1C=C2C=CCNC2=NC1.
What is the InChIKey of 7,8-dihydro-2H-1,8-naphthyridin-3-one?
The InChIKey is VFSZODBRSKQKSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2O/c11-7-4-6-2-1-3-9-8(6)10-5-7/h1-2,4H,3,5H2,(H,9,10).
What are the key properties of 7,8-dihydro-2H-1,8-naphthyridin-3-one?
7,8-dihydro-2H-1,8-naphthyridin-3-one has a molecular weight of 148.16 g/mol, XLogP of 0.05, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7,8-dihydro-2H-1,8-naphthyridin-3-one is sourced from PubChem (CID 174794414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).