1-ethyl-5,7-dimethyl-1,8-naphthyridin-2-one

C12H14N2O — CID 90668675

IUPAC1-ethyl-5,7-dimethyl-1,8-naphthyridin-2-one
SMILESCCn1c(=O)ccc2c(C)cc(C)nc21
InChIInChI=1S/C12H14N2O/c1-4-14-11(15)6-5-10-8(2)7-9(3)13-12(10)14/h5-7H,4H2,1-3H3
InChIKeyWWWOSHGSCWSTNT-UHFFFAOYSA-N
MW202.26 g/mol
LogP2.03
Rot. Bonds1

About 1-ethyl-5,7-dimethyl-1,8-naphthyridin-2-one

1-ethyl-5,7-dimethyl-1,8-naphthyridin-2-one (PubChem CID 90668675) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is 1-ethyl-5,7-dimethyl-1,8-naphthyridin-2-one.

Molecular Properties

Compound Name1-ethyl-5,7-dimethyl-1,8-naphthyridin-2-one
PubChem CID90668675
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC Name1-ethyl-5,7-dimethyl-1,8-naphthyridin-2-one
SMILESCCn1c(=O)ccc2c(C)cc(C)nc21
InChIInChI=1S/C12H14N2O/c1-4-14-11(15)6-5-10-8(2)7-9(3)13-12(10)14/h5-7H,4H2,1-3H3
InChIKeyWWWOSHGSCWSTNT-UHFFFAOYSA-N
XLogP2.03
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 52.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

7-Amino-1,8-naphthyridin-2(1H)-one
CID 5464536
N-(3-Cyano-4,6-dimethyl-pyridin-2-yl)-N-p-tolyl-acetamide
CID 781001
1-Benzyl-3-(6-methylpyridin-2-yl)urea
CID 16764115
N-(3-cyano-4,6-dimethylpyridin-2-yl)-N-phenylacetamide
CID 740890
1-(3-chlorobenzyl)-5,7-dimethyl[1,8]naphthyridin-2(1H)-one
CID 901093
7-methyl-6-pyridin-4-yl-1H-1,8-naphthyridin-2-one
CID 10354140
4-(4-Fluorophenyl)-1,5,7-trimethyl-2-oxo-1,8-naphthyridine-3-carbonitrile
CID 4289166
N-cyclohexyl-3-phenyl-N-2-pyridinylacrylamide
CID 800217
7-Amino-4-methyl-1,8-naphthyridin-2-ol
CID 5354050
5,7-dimethyl-1,8-naphthyridin-2(1H)-one
CID 5374405
1-(2-hydroxypyridin-4-yl)-4-(methyl-amino)-7-(trifluoromethyl)-pyrido[2,3-d]pyrimidin-2(1H)-one
CID 153608766
1,8-Naphthyridin-2(1H)-one, 3-methyl-1-(3-methylbutyl)-
CID 3073166

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-5,7-dimethyl-1,8-naphthyridin-2-one?
The IUPAC name of 1-ethyl-5,7-dimethyl-1,8-naphthyridin-2-one (CID 90668675) is 1-ethyl-5,7-dimethyl-1,8-naphthyridin-2-one.
What is the SMILES notation for 1-ethyl-5,7-dimethyl-1,8-naphthyridin-2-one?
The canonical SMILES for 1-ethyl-5,7-dimethyl-1,8-naphthyridin-2-one is CCn1c(=O)ccc2c(C)cc(C)nc21.
What is the InChIKey of 1-ethyl-5,7-dimethyl-1,8-naphthyridin-2-one?
The InChIKey is WWWOSHGSCWSTNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c1-4-14-11(15)6-5-10-8(2)7-9(3)13-12(10)14/h5-7H,4H2,1-3H3.
What are the key properties of 1-ethyl-5,7-dimethyl-1,8-naphthyridin-2-one?
1-ethyl-5,7-dimethyl-1,8-naphthyridin-2-one has a molecular weight of 202.26 g/mol, XLogP of 2.03, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-5,7-dimethyl-1,8-naphthyridin-2-one is sourced from PubChem (CID 90668675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).