3-methyl-5,8-dihydro-2H-2,6-naphthyridin-1-one

C9H10N2O — CID 91166669

IUPAC3-methyl-5,8-dihydro-2H-2,6-naphthyridin-1-one
SMILESCc1cc2c(c(=O)[nH]1)CC=NC2
InChIInChI=1S/C9H10N2O/c1-6-4-7-5-10-3-2-8(7)9(12)11-6/h3-4H,2,5H2,1H3,(H,11,12)
InChIKeyLAVDOOPHUVFFFC-UHFFFAOYSA-N
MW162.19 g/mol
LogP0.81
Rot. Bonds

About 3-methyl-5,8-dihydro-2H-2,6-naphthyridin-1-one

3-methyl-5,8-dihydro-2H-2,6-naphthyridin-1-one (PubChem CID 91166669) has the molecular formula C9H10N2O and a molecular weight of 162.19 g/mol. Its IUPAC name is 3-methyl-5,8-dihydro-2H-2,6-naphthyridin-1-one.

Molecular Properties

Compound Name3-methyl-5,8-dihydro-2H-2,6-naphthyridin-1-one
PubChem CID91166669
Molecular FormulaC9H10N2O
Molecular Weight162.19 g/mol
Exact Mass162.08
IUPAC Name3-methyl-5,8-dihydro-2H-2,6-naphthyridin-1-one
SMILESCc1cc2c(c(=O)[nH]1)CC=NC2
InChIInChI=1S/C9H10N2O/c1-6-4-7-5-10-3-2-8(7)9(12)11-6/h3-4H,2,5H2,1H3,(H,11,12)
InChIKeyLAVDOOPHUVFFFC-UHFFFAOYSA-N
XLogP0.81
TPSA45.22 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.19
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-5,8-dihydro-2H-2,6-naphthyridin-1-one?
The IUPAC name of 3-methyl-5,8-dihydro-2H-2,6-naphthyridin-1-one (CID 91166669) is 3-methyl-5,8-dihydro-2H-2,6-naphthyridin-1-one.
What is the SMILES notation for 3-methyl-5,8-dihydro-2H-2,6-naphthyridin-1-one?
The canonical SMILES for 3-methyl-5,8-dihydro-2H-2,6-naphthyridin-1-one is Cc1cc2c(c(=O)[nH]1)CC=NC2.
What is the InChIKey of 3-methyl-5,8-dihydro-2H-2,6-naphthyridin-1-one?
The InChIKey is LAVDOOPHUVFFFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O/c1-6-4-7-5-10-3-2-8(7)9(12)11-6/h3-4H,2,5H2,1H3,(H,11,12).
What are the key properties of 3-methyl-5,8-dihydro-2H-2,6-naphthyridin-1-one?
3-methyl-5,8-dihydro-2H-2,6-naphthyridin-1-one has a molecular weight of 162.19 g/mol, XLogP of 0.81, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5,8-dihydro-2H-2,6-naphthyridin-1-one is sourced from PubChem (CID 91166669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).