N-(2-methyl-4-oxoquinazolin-3-yl)benzamide

C16H13N3O2 — CID 807598

IUPACN-(2-methyl-4-oxoquinazolin-3-yl)benzamide
SMILESCc1nc2ccccc2c(=O)n1NC(=O)c1ccccc1
InChIInChI=1S/C16H13N3O2/c1-11-17-14-10-6-5-9-13(14)16(21)19(11)18-15(20)12-7-3-2-4-8-12/h2-10H,1H3,(H,18,20)
InChIKeyJQCDMRJKMBYDBB-UHFFFAOYSA-N
MW279.30 g/mol
LogP2.09
Rot. Bonds2

About N-(2-methyl-4-oxoquinazolin-3-yl)benzamide

N-(2-methyl-4-oxoquinazolin-3-yl)benzamide (PubChem CID 807598) has the molecular formula C16H13N3O2 and a molecular weight of 279.30 g/mol. Its IUPAC name is N-(2-methyl-4-oxoquinazolin-3-yl)benzamide.

Molecular Properties

Compound NameN-(2-methyl-4-oxoquinazolin-3-yl)benzamide
PubChem CID807598
Molecular FormulaC16H13N3O2
Molecular Weight279.30 g/mol
Exact Mass279.10
IUPAC NameN-(2-methyl-4-oxoquinazolin-3-yl)benzamide
SMILESCc1nc2ccccc2c(=O)n1NC(=O)c1ccccc1
InChIInChI=1S/C16H13N3O2/c1-11-17-14-10-6-5-9-13(14)16(21)19(11)18-15(20)12-7-3-2-4-8-12/h2-10H,1H3,(H,18,20)
InChIKeyJQCDMRJKMBYDBB-UHFFFAOYSA-N
XLogP2.09
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.30
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methyl-4-oxoquinazolin-3-yl)-3-phenoxybenzamide
CID 2545082
4-(difluoromethoxy)-N-(2-methyl-4-oxoquinazolin-3-yl)benzamide
CID 9105716
2-amino-N-(2-methyl-4-oxoquinazolin-3-yl)benzamide
CID 4778135
N-(2-methylbenzimidazol-1-yl)benzamide
CID 71380365
N-[2-(3-methylphenyl)-4-oxoquinazolin-3-yl]benzamide
CID 170732468
N-[2-(4-fluorophenyl)-4-oxoquinazolin-3-yl]benzamide
CID 23932693
N-(2-methyl-4-oxoquinazolin-3-yl)hexanamide
CID 5090042
4-tert-butyl-N-(4-oxo-2-pyridin-2-ylquinazolin-3-yl)benzamide
CID 23854731
4-bromo-N-[2-(4-tert-butylphenyl)-4-oxoquinazolin-3-yl]benzamide
CID 23968802
4-methoxy-N-(4-oxo-2-pyridin-4-ylquinazolin-3-yl)benzamide
CID 23797785
N-[2-(4-chlorophenyl)-4-oxoquinazolin-3-yl]-4-ethylbenzamide
CID 23740001
3-methyl-N-(4-oxo-2-pyridin-4-ylquinazolin-3-yl)benzamide
CID 23881942

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-4-oxoquinazolin-3-yl)benzamide?
The IUPAC name of N-(2-methyl-4-oxoquinazolin-3-yl)benzamide (CID 807598) is N-(2-methyl-4-oxoquinazolin-3-yl)benzamide.
What is the SMILES notation for N-(2-methyl-4-oxoquinazolin-3-yl)benzamide?
The canonical SMILES for N-(2-methyl-4-oxoquinazolin-3-yl)benzamide is Cc1nc2ccccc2c(=O)n1NC(=O)c1ccccc1.
What is the InChIKey of N-(2-methyl-4-oxoquinazolin-3-yl)benzamide?
The InChIKey is JQCDMRJKMBYDBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N3O2/c1-11-17-14-10-6-5-9-13(14)16(21)19(11)18-15(20)12-7-3-2-4-8-12/h2-10H,1H3,(H,18,20).
What are the key properties of N-(2-methyl-4-oxoquinazolin-3-yl)benzamide?
N-(2-methyl-4-oxoquinazolin-3-yl)benzamide has a molecular weight of 279.30 g/mol, XLogP of 2.09, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-4-oxoquinazolin-3-yl)benzamide is sourced from PubChem (CID 807598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).