N-(5-cyano-2-methoxyphenyl)-4-(2-methyl-4-oxoquinazolin-3-yl)benzamide

C24H18N4O3 — CID 49182677

IUPACN-(5-cyano-2-methoxyphenyl)-4-(2-methyl-4-oxoquinazolin-3-yl)benzamide
SMILESCOc1ccc(C#N)cc1NC(=O)c1ccc(-n2c(C)nc3ccccc3c2=O)cc1
InChIInChI=1S/C24H18N4O3/c1-15-26-20-6-4-3-5-19(20)24(30)28(15)18-10-8-17(9-11-18)23(29)27-21-13-16(14-25)7-12-22(21)31-2/h3-13H,1-2H3,(H,27,29)
InChIKeyDYFZFLJNJIQCQN-UHFFFAOYSA-N
MW410.43 g/mol
LogP3.83
Rot. Bonds4

About N-(5-cyano-2-methoxyphenyl)-4-(2-methyl-4-oxoquinazolin-3-yl)benzamide

N-(5-cyano-2-methoxyphenyl)-4-(2-methyl-4-oxoquinazolin-3-yl)benzamide (PubChem CID 49182677) has the molecular formula C24H18N4O3 and a molecular weight of 410.43 g/mol. Its IUPAC name is N-(5-cyano-2-methoxyphenyl)-4-(2-methyl-4-oxoquinazolin-3-yl)benzamide.

Molecular Properties

Compound NameN-(5-cyano-2-methoxyphenyl)-4-(2-methyl-4-oxoquinazolin-3-yl)benzamide
PubChem CID49182677
Molecular FormulaC24H18N4O3
Molecular Weight410.43 g/mol
Exact Mass410.14
IUPAC NameN-(5-cyano-2-methoxyphenyl)-4-(2-methyl-4-oxoquinazolin-3-yl)benzamide
SMILESCOc1ccc(C#N)cc1NC(=O)c1ccc(-n2c(C)nc3ccccc3c2=O)cc1
InChIInChI=1S/C24H18N4O3/c1-15-26-20-6-4-3-5-19(20)24(30)28(15)18-10-8-17(9-11-18)23(29)27-21-13-16(14-25)7-12-22(21)31-2/h3-13H,1-2H3,(H,27,29)
InChIKeyDYFZFLJNJIQCQN-UHFFFAOYSA-N
XLogP3.83
TPSA97.01 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.43
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-(5-cyano-2-methoxyphenyl)-4-(2-methyl-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

3,4,5-trimethoxy-N-[2-methoxy-4-(2-methyl-4-oxoquinazolin-3-yl)phenyl]benzamide
CID 43988488
4-butoxy-N-[2-methoxy-4-(2-methyl-4-oxoquinazolin-3-yl)phenyl]benzamide
CID 43988524
methyl 3-[[4-(2-methyl-4-oxoquinazolin-3-yl)benzoyl]amino]thiophene-2-carboxylate
CID 36670505
2-[[4-(2-methyl-4-oxoquinazolin-3-yl)benzoyl]amino]benzamide
CID 9399217
4-methyl-N-[4-(2-methyl-4-oxoquinazolin-3-yl)phenyl]benzamide
CID 7294843
N-[2-methoxy-4-(2-methyl-4-oxoquinazolin-3-yl)phenyl]-3,5-dinitrobenzamide
CID 43988567
N-[2-(4-methoxyphenoxy)-3-pyridinyl]-4-(2-methyl-4-oxoquinazolin-3-yl)benzamide
CID 55661317
N-(3-iodo-4-methylphenyl)-4-(2-methyl-4-oxoquinazolin-3-yl)benzamide
CID 46809727
N-[2-fluoro-5-(2-methyl-4-oxoquinazolin-3-yl)phenyl]-4-methylbenzamide
CID 7593064
N-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]-4-(2-methyl-4-oxoquinazolin-3-yl)benzamide
CID 39218858
N-(5-cyano-2-methoxyphenyl)pyridine-4-carboxamide
CID 49183025
4-(2-methyl-4-oxoquinazolin-3-yl)-N-(2-methyl-4-pyrimidin-2-yloxyphenyl)benzamide
CID 60589902

Frequently Asked Questions

What is the IUPAC name of N-(5-cyano-2-methoxyphenyl)-4-(2-methyl-4-oxoquinazolin-3-yl)benzamide?
The IUPAC name of N-(5-cyano-2-methoxyphenyl)-4-(2-methyl-4-oxoquinazolin-3-yl)benzamide (CID 49182677) is N-(5-cyano-2-methoxyphenyl)-4-(2-methyl-4-oxoquinazolin-3-yl)benzamide.
What is the SMILES notation for N-(5-cyano-2-methoxyphenyl)-4-(2-methyl-4-oxoquinazolin-3-yl)benzamide?
The canonical SMILES for N-(5-cyano-2-methoxyphenyl)-4-(2-methyl-4-oxoquinazolin-3-yl)benzamide is COc1ccc(C#N)cc1NC(=O)c1ccc(-n2c(C)nc3ccccc3c2=O)cc1.
What is the InChIKey of N-(5-cyano-2-methoxyphenyl)-4-(2-methyl-4-oxoquinazolin-3-yl)benzamide?
The InChIKey is DYFZFLJNJIQCQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18N4O3/c1-15-26-20-6-4-3-5-19(20)24(30)28(15)18-10-8-17(9-11-18)23(29)27-21-13-16(14-25)7-12-22(21)31-2/h3-13H,1-2H3,(H,27,29).
What are the key properties of N-(5-cyano-2-methoxyphenyl)-4-(2-methyl-4-oxoquinazolin-3-yl)benzamide?
N-(5-cyano-2-methoxyphenyl)-4-(2-methyl-4-oxoquinazolin-3-yl)benzamide has a molecular weight of 410.43 g/mol, XLogP of 3.83, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cyano-2-methoxyphenyl)-4-(2-methyl-4-oxoquinazolin-3-yl)benzamide is sourced from PubChem (CID 49182677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).