3-methyl-5,8-dihydro-2H-2,7-naphthyridin-1-one

C9H10N2O — CID 91092802

IUPAC3-methyl-5,8-dihydro-2H-2,7-naphthyridin-1-one
SMILESCc1cc2c(c(=O)[nH]1)CN=CC2
InChIInChI=1S/C9H10N2O/c1-6-4-7-2-3-10-5-8(7)9(12)11-6/h3-4H,2,5H2,1H3,(H,11,12)
InChIKeyHTKGVDHPLIHGRS-UHFFFAOYSA-N
MW162.19 g/mol
LogP0.81
Rot. Bonds

About 3-methyl-5,8-dihydro-2H-2,7-naphthyridin-1-one

3-methyl-5,8-dihydro-2H-2,7-naphthyridin-1-one (PubChem CID 91092802) has the molecular formula C9H10N2O and a molecular weight of 162.19 g/mol. Its IUPAC name is 3-methyl-5,8-dihydro-2H-2,7-naphthyridin-1-one.

Molecular Properties

Compound Name3-methyl-5,8-dihydro-2H-2,7-naphthyridin-1-one
PubChem CID91092802
Molecular FormulaC9H10N2O
Molecular Weight162.19 g/mol
Exact Mass162.08
IUPAC Name3-methyl-5,8-dihydro-2H-2,7-naphthyridin-1-one
SMILESCc1cc2c(c(=O)[nH]1)CN=CC2
InChIInChI=1S/C9H10N2O/c1-6-4-7-2-3-10-5-8(7)9(12)11-6/h3-4H,2,5H2,1H3,(H,11,12)
InChIKeyHTKGVDHPLIHGRS-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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Related Compounds

3-methyl-8,8a-dihydro-2H-2,7-naphthyridin-1-one
CID 59652318
3-(aminomethyl)-4-ethyl-6-methylpyridin-2(1H)-one
CID 67466583
7,8-dihydro-1H-1,6-naphthyridin-2-one
CID 68299465
6-(1-imino-3-methyliminopropan-2-yl)-3-methyl-1H-pyridin-2-one
CID 90889194
3-methyl-5,8-dihydro-2H-2,6-naphthyridin-1-one
CID 91166669
4-(aminomethyl)-1-methyl-2H-isoquinolin-3-one
CID 118095584
4-(aminomethyl)-1,7-dimethyl-2H-isoquinolin-3-one
CID 118101308
N-(3-ethylcyclohexa-1,3-dien-1-yl)-3,4-dihydropyridine-6-carboxamide
CID 123154970
4-ethyl-3-methanimidoyl-6-methyl-1H-pyridin-2-one
CID 137078769
8-methyl-7,8-dihydro-1H-1,6-naphthyridin-2-one
CID 141412925
4,6-dimethyl-3-[(methylideneamino)methyl]-1H-pyridin-2-one
CID 147721930
1-ethyl-2H-2,7-naphthyridin-3-one
CID 156703532

Frequently Asked Questions

What is the IUPAC name of 3-methyl-5,8-dihydro-2H-2,7-naphthyridin-1-one?
The IUPAC name of 3-methyl-5,8-dihydro-2H-2,7-naphthyridin-1-one (CID 91092802) is 3-methyl-5,8-dihydro-2H-2,7-naphthyridin-1-one.
What is the SMILES notation for 3-methyl-5,8-dihydro-2H-2,7-naphthyridin-1-one?
The canonical SMILES for 3-methyl-5,8-dihydro-2H-2,7-naphthyridin-1-one is Cc1cc2c(c(=O)[nH]1)CN=CC2.
What is the InChIKey of 3-methyl-5,8-dihydro-2H-2,7-naphthyridin-1-one?
The InChIKey is HTKGVDHPLIHGRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O/c1-6-4-7-2-3-10-5-8(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-2,7-naphthyridin-1-one?
3-methyl-5,8-dihydro-2H-2,7-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-2,7-naphthyridin-1-one is sourced from PubChem (CID 91092802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).