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

C8H6N2O — CID 67130986

IUPAC3H-1,8-naphthyridin-2-one
SMILESO=C1CC=c2cccnc2=N1
InChIInChI=1S/C8H6N2O/c11-7-4-3-6-2-1-5-9-8(6)10-7/h1-3,5H,4H2
InChIKeyMAFNRUCHZXOWNN-UHFFFAOYSA-N
MW146.15 g/mol
LogP-0.59
Rot. Bonds

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

3H-1,8-naphthyridin-2-one (PubChem CID 67130986) has the molecular formula C8H6N2O and a molecular weight of 146.15 g/mol. Its IUPAC name is 3H-1,8-naphthyridin-2-one.

Molecular Properties

Compound Name3H-1,8-naphthyridin-2-one
PubChem CID67130986
Molecular FormulaC8H6N2O
Molecular Weight146.15 g/mol
Exact Mass146.05
IUPAC Name3H-1,8-naphthyridin-2-one
SMILESO=C1CC=c2cccnc2=N1
InChIInChI=1S/C8H6N2O/c11-7-4-3-6-2-1-5-9-8(6)10-7/h1-3,5H,4H2
InChIKeyMAFNRUCHZXOWNN-UHFFFAOYSA-N
XLogP-0.59
TPSA42.32 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.15
LogP ≤ 5-0.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Naphthyridin-6(7h)-one
CID 20059022
8-Oxopyrido[2,3-b]azepine
CID 54484510
Naphthyridinedione
CID 66764726
Pyrido[2,3-d]pyrimidine-7-one
CID 66787659
Thioxonaphthyridinon
CID 129646973
Spiro[imidazole-4,3'-quinolin]one
CID 155928124
3-(trifluoromethyl)-3H-1,8-naphthyridin-2-one
CID 77620779
Pyrrolo[2,3-b]pyridin-2-one
CID 21907087
7H-1,8-naphthyridin-3-one
CID 54258802
4aH-pyrido[2,3-d]pyrimidin-4-one
CID 57073138
4,6,8,10-Tetrazatricyclo[7.4.0.02,7]trideca-1,3,6,8,10,12-hexaen-5-one
CID 66769975
2-amino-6H-pyrido[2,3-d]pyrimidin-7-one
CID 67237080

Frequently Asked Questions

What is the IUPAC name of 3H-1,8-naphthyridin-2-one?
The IUPAC name of 3H-1,8-naphthyridin-2-one (CID 67130986) is 3H-1,8-naphthyridin-2-one.
What is the SMILES notation for 3H-1,8-naphthyridin-2-one?
The canonical SMILES for 3H-1,8-naphthyridin-2-one is O=C1CC=c2cccnc2=N1.
What is the InChIKey of 3H-1,8-naphthyridin-2-one?
The InChIKey is MAFNRUCHZXOWNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6N2O/c11-7-4-3-6-2-1-5-9-8(6)10-7/h1-3,5H,4H2.
What are the key properties of 3H-1,8-naphthyridin-2-one?
3H-1,8-naphthyridin-2-one has a molecular weight of 146.15 g/mol, XLogP of -0.59, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3H-1,8-naphthyridin-2-one is sourced from PubChem (CID 67130986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).