3,4-dimethyl-5-methylidene-1-quinolin-8-ylpyrrol-2-one

C16H14N2O — CID 141397224

IUPAC3,4-dimethyl-5-methylidene-1-quinolin-8-ylpyrrol-2-one
SMILESC=C1C(C)=C(C)C(=O)N1c1cccc2cccnc12
InChIInChI=1S/C16H14N2O/c1-10-11(2)16(19)18(12(10)3)14-8-4-6-13-7-5-9-17-15(13)14/h4-9H,3H2,1-2H3
InChIKeyCCHWINWMZKAABV-UHFFFAOYSA-N
MW250.30 g/mol
LogP3.43
Rot. Bonds1

About 3,4-dimethyl-5-methylidene-1-quinolin-8-ylpyrrol-2-one

3,4-dimethyl-5-methylidene-1-quinolin-8-ylpyrrol-2-one (PubChem CID 141397224) has the molecular formula C16H14N2O and a molecular weight of 250.30 g/mol. Its IUPAC name is 3,4-dimethyl-5-methylidene-1-quinolin-8-ylpyrrol-2-one.

Molecular Properties

Compound Name3,4-dimethyl-5-methylidene-1-quinolin-8-ylpyrrol-2-one
PubChem CID141397224
Molecular FormulaC16H14N2O
Molecular Weight250.30 g/mol
Exact Mass250.11
IUPAC Name3,4-dimethyl-5-methylidene-1-quinolin-8-ylpyrrol-2-one
SMILESC=C1C(C)=C(C)C(=O)N1c1cccc2cccnc12
InChIInChI=1S/C16H14N2O/c1-10-11(2)16(19)18(12(10)3)14-8-4-6-13-7-5-9-17-15(13)14/h4-9H,3H2,1-2H3
InChIKeyCCHWINWMZKAABV-UHFFFAOYSA-N
XLogP3.43
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 53.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3,4-dimethyl-5-methylidene-1-quinolin-8-ylpyrrol-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

6-methyl-3-methylidene-2-quinolin-8-ylisoindol-1-one
CID 141397233
5-bromo-3-methylidene-2-quinolin-8-ylisoindol-1-one
CID 174756197
5,6-dichloro-2-quinolin-8-ylisoindole-1,3-dione
CID 2168091
3-quinolin-8-ylimidazolidine-2,4-dione
CID 106702916
(3Z)-2-quinolin-8-yl-3-[tri(propan-2-yl)silylmethylidene]isoindol-1-one
CID 166443807
8-(3-methyl-1,2,4-triazol-1-yl)quinoline
CID 166607439
3-(2,6-dimethylphenyl)imino-2-quinolin-8-ylpyrrolo[3,4-c]pyridin-1-one
CID 166443239
1-methyl-5-quinolin-8-ylphenanthridin-6-one
CID 164682820
3,4-dimethyl-1-(3-methyl-2-pyridinyl)pyrrole-2,5-dione
CID 45093444
5-methyl-3-quinolin-8-yl-1H-imidazole-2-thione
CID 81335602
(3E)-3-benzylidene-5-methoxy-2-quinolin-8-ylisoindol-1-one
CID 122382793
5-bromo-3-(2,6-dimethylphenyl)imino-2-quinolin-8-ylisoindol-1-one
CID 122202711

Frequently Asked Questions

What is the IUPAC name of 3,4-dimethyl-5-methylidene-1-quinolin-8-ylpyrrol-2-one?
The IUPAC name of 3,4-dimethyl-5-methylidene-1-quinolin-8-ylpyrrol-2-one (CID 141397224) is 3,4-dimethyl-5-methylidene-1-quinolin-8-ylpyrrol-2-one.
What is the SMILES notation for 3,4-dimethyl-5-methylidene-1-quinolin-8-ylpyrrol-2-one?
The canonical SMILES for 3,4-dimethyl-5-methylidene-1-quinolin-8-ylpyrrol-2-one is C=C1C(C)=C(C)C(=O)N1c1cccc2cccnc12.
What is the InChIKey of 3,4-dimethyl-5-methylidene-1-quinolin-8-ylpyrrol-2-one?
The InChIKey is CCHWINWMZKAABV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O/c1-10-11(2)16(19)18(12(10)3)14-8-4-6-13-7-5-9-17-15(13)14/h4-9H,3H2,1-2H3.
What are the key properties of 3,4-dimethyl-5-methylidene-1-quinolin-8-ylpyrrol-2-one?
3,4-dimethyl-5-methylidene-1-quinolin-8-ylpyrrol-2-one has a molecular weight of 250.30 g/mol, XLogP of 3.43, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethyl-5-methylidene-1-quinolin-8-ylpyrrol-2-one is sourced from PubChem (CID 141397224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).