6H-1,6-naphthyridin-7-one

C8H6N2O — CID 57421642

IUPAC6H-1,6-naphthyridin-7-one
SMILESO=c1cc2ncccc2c[nH]1
InChIInChI=1S/C8H6N2O/c11-8-4-7-6(5-10-8)2-1-3-9-7/h1-5H,(H,10,11)
InChIKeyNEVVPGYITMZTFR-UHFFFAOYSA-N
MW146.15 g/mol
LogP0.92
Rot. Bonds

About 6H-1,6-naphthyridin-7-one

6H-1,6-naphthyridin-7-one (PubChem CID 57421642) has the molecular formula C8H6N2O and a molecular weight of 146.15 g/mol. Its IUPAC name is 6H-1,6-naphthyridin-7-one.

Molecular Properties

Compound Name6H-1,6-naphthyridin-7-one
PubChem CID57421642
Molecular FormulaC8H6N2O
Molecular Weight146.15 g/mol
Exact Mass146.05
IUPAC Name6H-1,6-naphthyridin-7-one
SMILESO=c1cc2ncccc2c[nH]1
InChIInChI=1S/C8H6N2O/c11-8-4-7-6(5-10-8)2-1-3-9-7/h1-5H,(H,10,11)
InChIKeyNEVVPGYITMZTFR-UHFFFAOYSA-N
XLogP0.92
TPSA45.75 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.15
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6H-1,6-naphthyridin-7-one?
The IUPAC name of 6H-1,6-naphthyridin-7-one (CID 57421642) is 6H-1,6-naphthyridin-7-one.
What is the SMILES notation for 6H-1,6-naphthyridin-7-one?
The canonical SMILES for 6H-1,6-naphthyridin-7-one is O=c1cc2ncccc2c[nH]1.
What is the InChIKey of 6H-1,6-naphthyridin-7-one?
The InChIKey is NEVVPGYITMZTFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6N2O/c11-8-4-7-6(5-10-8)2-1-3-9-7/h1-5H,(H,10,11).
What are the key properties of 6H-1,6-naphthyridin-7-one?
6H-1,6-naphthyridin-7-one has a molecular weight of 146.15 g/mol, XLogP of 0.92, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6H-1,6-naphthyridin-7-one is sourced from PubChem (CID 57421642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).