4aH-1,6-naphthyridin-2-one

C8H6N2O — CID 71302030

IUPAC4aH-1,6-naphthyridin-2-one
SMILESO=C1C=CC2C=NC=CC2=N1
InChIInChI=1S/C8H6N2O/c11-8-2-1-6-5-9-4-3-7(6)10-8/h1-6H
InChIKeyBWUUKDPKNPXJNP-UHFFFAOYSA-N
MW146.15 g/mol
LogP0.74
Rot. Bonds

About 4aH-1,6-naphthyridin-2-one

4aH-1,6-naphthyridin-2-one (PubChem CID 71302030) has the molecular formula C8H6N2O and a molecular weight of 146.15 g/mol. Its IUPAC name is 4aH-1,6-naphthyridin-2-one.

Molecular Properties

Compound Name4aH-1,6-naphthyridin-2-one
PubChem CID71302030
Molecular FormulaC8H6N2O
Molecular Weight146.15 g/mol
Exact Mass146.05
IUPAC Name4aH-1,6-naphthyridin-2-one
SMILESO=C1C=CC2C=NC=CC2=N1
InChIInChI=1S/C8H6N2O/c11-8-2-1-6-5-9-4-3-7(6)10-8/h1-6H
InChIKeyBWUUKDPKNPXJNP-UHFFFAOYSA-N
XLogP0.74
TPSA41.79 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 ≤ 50.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-Azaindolone
CID 21956213
Pyrrolo[3,2-g]quinolin-7-one
CID 132275779
7-fluoro-4aH-1,6-naphthyridin-2-one
CID 73740809
7-fluoro-4aH-1,5-naphthyridin-2-one
CID 75247395
7-chloro-8-fluoro-4aH-1,6-naphthyridin-2-one
CID 178188834
Pyrido[2,3-g]quinoxaline-2,7-dione
CID 18416205
3H-1,6-naphthyridin-2-one
CID 60160793
Pyrrolo[3,4-f]quinolin-7-one
CID 89189092
8H-1,5-naphthyridin-2-one
CID 145332952
Pyrido[4,3-b]azepin-2-one
CID 150558869
Pyrido[3,2-e][1,4]diazepin-7-one
CID 152513163
Pyrido[2,3-h][3]benzazepin-2-one
CID 154245543

Frequently Asked Questions

What is the IUPAC name of 4aH-1,6-naphthyridin-2-one?
The IUPAC name of 4aH-1,6-naphthyridin-2-one (CID 71302030) is 4aH-1,6-naphthyridin-2-one.
What is the SMILES notation for 4aH-1,6-naphthyridin-2-one?
The canonical SMILES for 4aH-1,6-naphthyridin-2-one is O=C1C=CC2C=NC=CC2=N1.
What is the InChIKey of 4aH-1,6-naphthyridin-2-one?
The InChIKey is BWUUKDPKNPXJNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6N2O/c11-8-2-1-6-5-9-4-3-7(6)10-8/h1-6H.
What are the key properties of 4aH-1,6-naphthyridin-2-one?
4aH-1,6-naphthyridin-2-one has a molecular weight of 146.15 g/mol, XLogP of 0.74, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4aH-1,6-naphthyridin-2-one is sourced from PubChem (CID 71302030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).