4H-1,6-naphthyridin-8-one

C8H6N2O — CID 91386663

IUPAC4H-1,6-naphthyridin-8-one
SMILESO=C1C=NC=C2CC=CN=C12
InChIInChI=1S/C8H6N2O/c11-7-5-9-4-6-2-1-3-10-8(6)7/h1,3-5H,2H2
InChIKeyDDVJLXBMCWNNKY-UHFFFAOYSA-N
MW146.15 g/mol
LogP0.88
Rot. Bonds

About 4H-1,6-naphthyridin-8-one

4H-1,6-naphthyridin-8-one (PubChem CID 91386663) has the molecular formula C8H6N2O and a molecular weight of 146.15 g/mol. Its IUPAC name is 4H-1,6-naphthyridin-8-one.

Molecular Properties

Compound Name4H-1,6-naphthyridin-8-one
PubChem CID91386663
Molecular FormulaC8H6N2O
Molecular Weight146.15 g/mol
Exact Mass146.05
IUPAC Name4H-1,6-naphthyridin-8-one
SMILESO=C1C=NC=C2CC=CN=C12
InChIInChI=1S/C8H6N2O/c11-7-5-9-4-6-2-1-3-10-8(6)7/h1,3-5H,2H2
InChIKeyDDVJLXBMCWNNKY-UHFFFAOYSA-N
XLogP0.88
TPSA41.79 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.15
LogP ≤ 50.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2H-1,6-naphthyridin-8-one
CID 66868347
4H-1,7-naphthyridin-8-one
CID 161202389
triazolo[4,5-c]pyridin-7-one
CID 141066869
5,6-dimethyl-4H-azepine
CID 123479096
4H-pyrrolo[2,3-b]pyridine
CID 152749055
3-oxo-4H-pyridine-2-carboxylic acid
CID 67519812
5H-1,3-diazepine-4-carboxylic acid
CID 69121664
6H-1,5-naphthyridin-4-one
CID 170347247
2-methylsulfinyl-3H-pyrrole
CID 159434011
2-(2-aminoethyl)-4H-pyridin-3-one
CID 69260747
5H-1,3-diazepine-4-carbaldehyde
CID 174467607
2-methyl-8H-pyrrolo[3,4-c]azepine-1,3-dione
CID 142053700

Frequently Asked Questions

What is the IUPAC name of 4H-1,6-naphthyridin-8-one?
The IUPAC name of 4H-1,6-naphthyridin-8-one (CID 91386663) is 4H-1,6-naphthyridin-8-one.
What is the SMILES notation for 4H-1,6-naphthyridin-8-one?
The canonical SMILES for 4H-1,6-naphthyridin-8-one is O=C1C=NC=C2CC=CN=C12.
What is the InChIKey of 4H-1,6-naphthyridin-8-one?
The InChIKey is DDVJLXBMCWNNKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6N2O/c11-7-5-9-4-6-2-1-3-10-8(6)7/h1,3-5H,2H2.
What are the key properties of 4H-1,6-naphthyridin-8-one?
4H-1,6-naphthyridin-8-one has a molecular weight of 146.15 g/mol, XLogP of 0.88, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4H-1,6-naphthyridin-8-one is sourced from PubChem (CID 91386663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).