4-ethyl-N-(4-oxoquinazolin-3-yl)benzamide

C17H15N3O2 — CID 5212758

IUPAC4-ethyl-N-(4-oxoquinazolin-3-yl)benzamide
SMILESCCc1ccc(C(=O)Nn2cnc3ccccc3c2=O)cc1
InChIInChI=1S/C17H15N3O2/c1-2-12-7-9-13(10-8-12)16(21)19-20-11-18-15-6-4-3-5-14(15)17(20)22/h3-11H,2H2,1H3,(H,19,21)
InChIKeyVONCDYSJINNJPU-UHFFFAOYSA-N
MW293.33 g/mol
LogP2.34
Rot. Bonds3

About 4-ethyl-N-(4-oxoquinazolin-3-yl)benzamide

4-ethyl-N-(4-oxoquinazolin-3-yl)benzamide (PubChem CID 5212758) has the molecular formula C17H15N3O2 and a molecular weight of 293.33 g/mol. Its IUPAC name is 4-ethyl-N-(4-oxoquinazolin-3-yl)benzamide.

Molecular Properties

Compound Name4-ethyl-N-(4-oxoquinazolin-3-yl)benzamide
PubChem CID5212758
Molecular FormulaC17H15N3O2
Molecular Weight293.33 g/mol
Exact Mass293.12
IUPAC Name4-ethyl-N-(4-oxoquinazolin-3-yl)benzamide
SMILESCCc1ccc(C(=O)Nn2cnc3ccccc3c2=O)cc1
InChIInChI=1S/C17H15N3O2/c1-2-12-7-9-13(10-8-12)16(21)19-20-11-18-15-6-4-3-5-14(15)17(20)22/h3-11H,2H2,1H3,(H,19,21)
InChIKeyVONCDYSJINNJPU-UHFFFAOYSA-N
XLogP2.34
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.33
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-ethyl-N-(4-oxoquinazolin-3-yl)benzamide 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

4(1H)-Quinazolinone
CID 135408753
3-Methyl-4(3H)-quinazolinone
CID 17088
2-Hydrazinyl-3-methyl-3,4-dihydroquinazolin-4-one
CID 376484
3-Amino-2-phenyl-4(3H)-quinazolinone
CID 722876
3-Amino-2-(p-tolyl)quinazolin-4(3H)-one
CID 854350
3-Amino-2-benzyl-3,4-dihydroquinazolin-4-one
CID 561230
4(3H)-Quinazolinone, 3-(phenylmethyl)-
CID 616746
3-Amino-2-(m-tolyl)quinazolin-4(3H)-one
CID 777429
3-Amino-4(3H)-quinazolinone
CID 63125
Centazolone
CID 72846
3-(2-oxo-2-phenylethyl)-4(3H)-quinazolinone
CID 738365
3-amino-2-methylquinazolin-4(3H)-one
CID 237591

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-(4-oxoquinazolin-3-yl)benzamide?
The IUPAC name of 4-ethyl-N-(4-oxoquinazolin-3-yl)benzamide (CID 5212758) is 4-ethyl-N-(4-oxoquinazolin-3-yl)benzamide.
What is the SMILES notation for 4-ethyl-N-(4-oxoquinazolin-3-yl)benzamide?
The canonical SMILES for 4-ethyl-N-(4-oxoquinazolin-3-yl)benzamide is CCc1ccc(C(=O)Nn2cnc3ccccc3c2=O)cc1.
What is the InChIKey of 4-ethyl-N-(4-oxoquinazolin-3-yl)benzamide?
The InChIKey is VONCDYSJINNJPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O2/c1-2-12-7-9-13(10-8-12)16(21)19-20-11-18-15-6-4-3-5-14(15)17(20)22/h3-11H,2H2,1H3,(H,19,21).
What are the key properties of 4-ethyl-N-(4-oxoquinazolin-3-yl)benzamide?
4-ethyl-N-(4-oxoquinazolin-3-yl)benzamide has a molecular weight of 293.33 g/mol, XLogP of 2.34, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-(4-oxoquinazolin-3-yl)benzamide is sourced from PubChem (CID 5212758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).