5,7-dimethyl-1-(2-phenylethyl)-1,8-naphthyridin-2-one

C18H18N2O — CID 139602583

IUPAC5,7-dimethyl-1-(2-phenylethyl)-1,8-naphthyridin-2-one
SMILESCc1cc(C)c2ccc(=O)n(CCc3ccccc3)c2n1
InChIInChI=1S/C18H18N2O/c1-13-12-14(2)19-18-16(13)8-9-17(21)20(18)11-10-15-6-4-3-5-7-15/h3-9,12H,10-11H2,1-2H3
InChIKeyHARLTWYPSYCHED-UHFFFAOYSA-N
MW278.36 g/mol
LogP3.26
Rot. Bonds3

About 5,7-dimethyl-1-(2-phenylethyl)-1,8-naphthyridin-2-one

5,7-dimethyl-1-(2-phenylethyl)-1,8-naphthyridin-2-one (PubChem CID 139602583) has the molecular formula C18H18N2O and a molecular weight of 278.36 g/mol. Its IUPAC name is 5,7-dimethyl-1-(2-phenylethyl)-1,8-naphthyridin-2-one.

Molecular Properties

Compound Name5,7-dimethyl-1-(2-phenylethyl)-1,8-naphthyridin-2-one
PubChem CID139602583
Molecular FormulaC18H18N2O
Molecular Weight278.36 g/mol
Exact Mass278.14
IUPAC Name5,7-dimethyl-1-(2-phenylethyl)-1,8-naphthyridin-2-one
SMILESCc1cc(C)c2ccc(=O)n(CCc3ccccc3)c2n1
InChIInChI=1S/C18H18N2O/c1-13-12-14(2)19-18-16(13)8-9-17(21)20(18)11-10-15-6-4-3-5-7-15/h3-9,12H,10-11H2,1-2H3
InChIKeyHARLTWYPSYCHED-UHFFFAOYSA-N
XLogP3.26
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 53.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 5,7-dimethyl-1-(2-phenylethyl)-1,8-naphthyridin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[2-[di(propan-2-yl)amino]ethyl]-5,7-dimethyl-1,8-naphthyridin-2-one
CID 22753551
1-(4-aminobutyl)-5,7-dimethyl-1,8-naphthyridin-2-one;hydrochloride
CID 23335414
5,7-dimethyl-1-[[3-(trifluoromethyl)phenyl]methyl]-1,8-naphthyridin-2-one
CID 16654130
6-methyl-3-(2-phenylethyl)-2-piperidin-1-ylpyrimidin-4-one
CID 30322612
2-(3-fluorophenyl)-6-methyl-3-(2-phenylethyl)pyrimidin-4-one
CID 143475083
8-benzyl-3-(2-phenylethyl)-1-propyl-7H-purine-2,6-dione
CID 18449569
1-benzyl-5,7-dimethylpyrido[2,3-d]pyrimidine-2,4-dione
CID 2101204
1-[2-(dimethylamino)ethyl]-5,7-dimethyl-1,8-naphthyridine-2-thione
CID 23335401
8-hydroxy-5-iodo-2-oxo-1-(2-phenylethyl)-1,6-naphthyridine-7-carboxylic acid
CID 174704654
5-ethyl-6-hydroxy-4-methyl-1-(2-phenylethyl)pyridin-2-one
CID 23338602
3-benzyl-5-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 82274273
1-(2-phenylethyl)-1,5-naphthyridin-2-one
CID 139602376

Frequently Asked Questions

What is the IUPAC name of 5,7-dimethyl-1-(2-phenylethyl)-1,8-naphthyridin-2-one?
The IUPAC name of 5,7-dimethyl-1-(2-phenylethyl)-1,8-naphthyridin-2-one (CID 139602583) is 5,7-dimethyl-1-(2-phenylethyl)-1,8-naphthyridin-2-one.
What is the SMILES notation for 5,7-dimethyl-1-(2-phenylethyl)-1,8-naphthyridin-2-one?
The canonical SMILES for 5,7-dimethyl-1-(2-phenylethyl)-1,8-naphthyridin-2-one is Cc1cc(C)c2ccc(=O)n(CCc3ccccc3)c2n1.
What is the InChIKey of 5,7-dimethyl-1-(2-phenylethyl)-1,8-naphthyridin-2-one?
The InChIKey is HARLTWYPSYCHED-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O/c1-13-12-14(2)19-18-16(13)8-9-17(21)20(18)11-10-15-6-4-3-5-7-15/h3-9,12H,10-11H2,1-2H3.
What are the key properties of 5,7-dimethyl-1-(2-phenylethyl)-1,8-naphthyridin-2-one?
5,7-dimethyl-1-(2-phenylethyl)-1,8-naphthyridin-2-one has a molecular weight of 278.36 g/mol, XLogP of 3.26, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-dimethyl-1-(2-phenylethyl)-1,8-naphthyridin-2-one is sourced from PubChem (CID 139602583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).