7-methyl-4-methylidene-3-phenyl-1H-quinazolin-2-one

C16H14N2O — CID 876691

IUPAC7-methyl-4-methylidene-3-phenyl-1H-quinazolin-2-one
SMILESC=C1c2ccc(C)cc2NC(=O)N1c1ccccc1
InChIInChI=1S/C16H14N2O/c1-11-8-9-14-12(2)18(13-6-4-3-5-7-13)16(19)17-15(14)10-11/h3-10H,2H2,1H3,(H,17,19)
InChIKeyFXABICCVZGLRKS-UHFFFAOYSA-N
MW250.30 g/mol
LogP4.02
Rot. Bonds1

About 7-methyl-4-methylidene-3-phenyl-1H-quinazolin-2-one

7-methyl-4-methylidene-3-phenyl-1H-quinazolin-2-one (PubChem CID 876691) has the molecular formula C16H14N2O and a molecular weight of 250.30 g/mol. Its IUPAC name is 7-methyl-4-methylidene-3-phenyl-1H-quinazolin-2-one.

Molecular Properties

Compound Name7-methyl-4-methylidene-3-phenyl-1H-quinazolin-2-one
PubChem CID876691
Molecular FormulaC16H14N2O
Molecular Weight250.30 g/mol
Exact Mass250.11
IUPAC Name7-methyl-4-methylidene-3-phenyl-1H-quinazolin-2-one
SMILESC=C1c2ccc(C)cc2NC(=O)N1c1ccccc1
InChIInChI=1S/C16H14N2O/c1-11-8-9-14-12(2)18(13-6-4-3-5-7-13)16(19)17-15(14)10-11/h3-10H,2H2,1H3,(H,17,19)
InChIKeyFXABICCVZGLRKS-UHFFFAOYSA-N
XLogP4.02
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

6-methyl-4-methylidene-3-(4-methylphenyl)-1H-quinazolin-2-one
CID 744400
3-benzylidene-6-methyl-1H-indol-2-one
CID 71248660
3-methyl-5,7-dihydrobenzo[d][1]benzazepin-6-one
CID 102201701
2-(3,5-dimethylphenyl)-6-methyl-1-methylidene-3,4-diphenylisoquinoline
CID 102335309
6-hydroxy-3-methylidene-2-(4-methylphenyl)isoindol-1-one
CID 102006043
(3E)-3-[[4-(3-chlorophenyl)piperazin-1-yl]methylidene]-6-methyl-1H-indol-2-one
CID 113196827
[3-(5-methyl-1,3-dioxoisoindol-2-yl)phenyl]-triphenylphosphanium
CID 59031839
6-methyl-2-phenyl-3,4-dihydroisoquinolin-1-one
CID 58318215
6-acetyl-3-methylidene-2-phenyl-5-prop-1-en-2-ylisoindol-1-one
CID 88979792
(3E)-6-methyl-3-[(4-methylpiperazin-1-yl)methylidene]-1H-indol-2-one
CID 113196779
6-methyl-1-phenyl-2H-indazol-3-one
CID 135011697
5-methyl-2-phenyl-3H-1,2,3-benzoxadiazole
CID 175723831

Frequently Asked Questions

What is the IUPAC name of 7-methyl-4-methylidene-3-phenyl-1H-quinazolin-2-one?
The IUPAC name of 7-methyl-4-methylidene-3-phenyl-1H-quinazolin-2-one (CID 876691) is 7-methyl-4-methylidene-3-phenyl-1H-quinazolin-2-one.
What is the SMILES notation for 7-methyl-4-methylidene-3-phenyl-1H-quinazolin-2-one?
The canonical SMILES for 7-methyl-4-methylidene-3-phenyl-1H-quinazolin-2-one is C=C1c2ccc(C)cc2NC(=O)N1c1ccccc1.
What is the InChIKey of 7-methyl-4-methylidene-3-phenyl-1H-quinazolin-2-one?
The InChIKey is FXABICCVZGLRKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O/c1-11-8-9-14-12(2)18(13-6-4-3-5-7-13)16(19)17-15(14)10-11/h3-10H,2H2,1H3,(H,17,19).
What are the key properties of 7-methyl-4-methylidene-3-phenyl-1H-quinazolin-2-one?
7-methyl-4-methylidene-3-phenyl-1H-quinazolin-2-one has a molecular weight of 250.30 g/mol, XLogP of 4.02, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-4-methylidene-3-phenyl-1H-quinazolin-2-one is sourced from PubChem (CID 876691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).