2-phenyl-3H-quinazolin-4-one

C14H10N2O — CID 135400456

IUPAC2-phenyl-3H-quinazolin-4-one
SMILESO=c1[nH]c(-c2ccccc2)nc2ccccc12
InChIInChI=1S/C14H10N2O/c17-14-11-8-4-5-9-12(11)15-13(16-14)10-6-2-1-3-7-10/h1-9H,(H,15,16,17)
InChIKeyVDULOAUXSMYUMG-UHFFFAOYSA-N
MW222.25 g/mol
LogP2.59
Rot. Bonds1

About 2-phenyl-3H-quinazolin-4-one

2-phenyl-3H-quinazolin-4-one (PubChem CID 135400456) has the molecular formula C14H10N2O and a molecular weight of 222.25 g/mol. Its IUPAC name is 2-phenyl-3H-quinazolin-4-one.

Molecular Properties

Compound Name2-phenyl-3H-quinazolin-4-one
PubChem CID135400456
Molecular FormulaC14H10N2O
Molecular Weight222.25 g/mol
Exact Mass222.08
IUPAC Name2-phenyl-3H-quinazolin-4-one
SMILESO=c1[nH]c(-c2ccccc2)nc2ccccc12
InChIInChI=1S/C14H10N2O/c17-14-11-8-4-5-9-12(11)15-13(16-14)10-6-2-1-3-7-10/h1-9H,(H,15,16,17)
InChIKeyVDULOAUXSMYUMG-UHFFFAOYSA-N
XLogP2.59
TPSA45.75 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.25
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-phenyl-3H-quinazolin-4-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

Methaqualone
CID 6292
4(1H)-Quinazolinone
CID 135408753
Afloqualone
CID 2040
2-Methyl-4(3H)-quinazolinone
CID 135400457
3-(2,4-dimethylphenyl)-2-methylquinazolin-4(3H)-one
CID 63382
2-Amino-3,4-dihydroquinazolin-4-one
CID 135403814
7,8,9,10-Tetrahydroazepino(2,1-b)quinazolin-12(6H)-one
CID 78144
4(3H)-Quinazolinone, 2-methyl-3-(2-methylphenyl)-, hydrochloride (1:1)
CID 63196
3-(2-Ethylphenyl)-2-methyl-4(3H)-quinazolinone
CID 23914
Deoxyvasicinone
CID 68261
(-)-6,7,7a,8-Tetrahydroquinazolino(3',2':1,6)pyrido(2,3-b)(1,4)benzodiazepine-9,16-dione
CID 130919
ME0328
CID 135566764

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-3H-quinazolin-4-one?
The IUPAC name of 2-phenyl-3H-quinazolin-4-one (CID 135400456) is 2-phenyl-3H-quinazolin-4-one.
What is the SMILES notation for 2-phenyl-3H-quinazolin-4-one?
The canonical SMILES for 2-phenyl-3H-quinazolin-4-one is O=c1[nH]c(-c2ccccc2)nc2ccccc12.
What is the InChIKey of 2-phenyl-3H-quinazolin-4-one?
The InChIKey is VDULOAUXSMYUMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N2O/c17-14-11-8-4-5-9-12(11)15-13(16-14)10-6-2-1-3-7-10/h1-9H,(H,15,16,17).
What are the key properties of 2-phenyl-3H-quinazolin-4-one?
2-phenyl-3H-quinazolin-4-one has a molecular weight of 222.25 g/mol, XLogP of 2.59, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-3H-quinazolin-4-one is sourced from PubChem (CID 135400456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).