N-(5-chloro-2-methylphenyl)-2-(4-oxoquinazolin-3-yl)acetamide

C17H14ClN3O2 — CID 853101

IUPACN-(5-chloro-2-methylphenyl)-2-(4-oxoquinazolin-3-yl)acetamide
SMILESCc1ccc(Cl)cc1NC(=O)Cn1cnc2ccccc2c1=O
InChIInChI=1S/C17H14ClN3O2/c1-11-6-7-12(18)8-15(11)20-16(22)9-21-10-19-14-5-3-2-4-13(14)17(21)23/h2-8,10H,9H2,1H3,(H,20,22)
InChIKeyFASMCYVDXFNBJD-UHFFFAOYSA-N
MW327.77 g/mol
LogP3.00
Rot. Bonds3

About N-(5-chloro-2-methylphenyl)-2-(4-oxoquinazolin-3-yl)acetamide

N-(5-chloro-2-methylphenyl)-2-(4-oxoquinazolin-3-yl)acetamide (PubChem CID 853101) has the molecular formula C17H14ClN3O2 and a molecular weight of 327.77 g/mol. Its IUPAC name is N-(5-chloro-2-methylphenyl)-2-(4-oxoquinazolin-3-yl)acetamide.

Molecular Properties

Compound NameN-(5-chloro-2-methylphenyl)-2-(4-oxoquinazolin-3-yl)acetamide
PubChem CID853101
Molecular FormulaC17H14ClN3O2
Molecular Weight327.77 g/mol
Exact Mass327.08
IUPAC NameN-(5-chloro-2-methylphenyl)-2-(4-oxoquinazolin-3-yl)acetamide
SMILESCc1ccc(Cl)cc1NC(=O)Cn1cnc2ccccc2c1=O
InChIInChI=1S/C17H14ClN3O2/c1-11-6-7-12(18)8-15(11)20-16(22)9-21-10-19-14-5-3-2-4-13(14)17(21)23/h2-8,10H,9H2,1H3,(H,20,22)
InChIKeyFASMCYVDXFNBJD-UHFFFAOYSA-N
XLogP3.00
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.77
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(5-chloro-2-methylphenyl)-2-(4-oxoquinazolin-3-yl)acetamide 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

2-methyl-N-[4-methyl-3-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]phenyl]propanamide
CID 55708476
N-(2,5-dichlorophenyl)-2-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]acetamide
CID 9440401
N-(2-chloro-4-methylphenyl)-2-(4-oxoquinazolin-3-yl)acetamide
CID 7874794
N-(4-chloro-2-methylphenyl)-2-(6-chloro-4-oxoquinazolin-3-yl)acetamide
CID 3475689
N-(3,4-dimethylphenyl)-2-(4-oxoquinazolin-3-yl)acetamide
CID 852114
2-(7-chloro-4-oxoquinazolin-3-yl)-N-(2-chlorophenyl)acetamide
CID 4193609
N-(5-chloro-2-fluorophenyl)-2-(8-methyl-4-oxoquinazolin-3-yl)acetamide
CID 51265002
N-(2-chloro-5-fluorophenyl)-2-(4-oxoquinazolin-3-yl)acetamide
CID 51363052
2-(6-bromo-4-oxoquinazolin-3-yl)-N-(4-chloro-2-methylphenyl)acetamide
CID 7275237
N-(3-chloro-2-methoxyphenyl)-2-(4-oxoquinazolin-3-yl)acetamide
CID 21231739
N-(4,6-dimethylpyrimidin-2-yl)-2-(4-oxoquinazolin-3-yl)acetamide
CID 155294773
N-(2-methylsulfanylphenyl)-2-(4-oxoquinazolin-3-yl)acetamide
CID 4808995

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methylphenyl)-2-(4-oxoquinazolin-3-yl)acetamide?
The IUPAC name of N-(5-chloro-2-methylphenyl)-2-(4-oxoquinazolin-3-yl)acetamide (CID 853101) is N-(5-chloro-2-methylphenyl)-2-(4-oxoquinazolin-3-yl)acetamide.
What is the SMILES notation for N-(5-chloro-2-methylphenyl)-2-(4-oxoquinazolin-3-yl)acetamide?
The canonical SMILES for N-(5-chloro-2-methylphenyl)-2-(4-oxoquinazolin-3-yl)acetamide is Cc1ccc(Cl)cc1NC(=O)Cn1cnc2ccccc2c1=O.
What is the InChIKey of N-(5-chloro-2-methylphenyl)-2-(4-oxoquinazolin-3-yl)acetamide?
The InChIKey is FASMCYVDXFNBJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14ClN3O2/c1-11-6-7-12(18)8-15(11)20-16(22)9-21-10-19-14-5-3-2-4-13(14)17(21)23/h2-8,10H,9H2,1H3,(H,20,22).
What are the key properties of N-(5-chloro-2-methylphenyl)-2-(4-oxoquinazolin-3-yl)acetamide?
N-(5-chloro-2-methylphenyl)-2-(4-oxoquinazolin-3-yl)acetamide has a molecular weight of 327.77 g/mol, XLogP of 3.00, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methylphenyl)-2-(4-oxoquinazolin-3-yl)acetamide is sourced from PubChem (CID 853101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).