N-[2-methyl-6-(3-oxo-4H-quinoxalin-2-yl)phenyl]benzamide

C22H17N3O2 — CID 27187078

IUPACN-[2-methyl-6-(3-oxo-4H-quinoxalin-2-yl)phenyl]benzamide
SMILESCc1cccc(-c2nc3ccccc3[nH]c2=O)c1NC(=O)c1ccccc1
InChIInChI=1S/C22H17N3O2/c1-14-8-7-11-16(19(14)25-21(26)15-9-3-2-4-10-15)20-22(27)24-18-13-6-5-12-17(18)23-20/h2-13H,1H3,(H,24,27)(H,25,26)
InChIKeyUZAWWUWJMDMYQG-UHFFFAOYSA-N
MW355.40 g/mol
LogP4.15
Rot. Bonds3

About N-[2-methyl-6-(3-oxo-4H-quinoxalin-2-yl)phenyl]benzamide

N-[2-methyl-6-(3-oxo-4H-quinoxalin-2-yl)phenyl]benzamide (PubChem CID 27187078) has the molecular formula C22H17N3O2 and a molecular weight of 355.40 g/mol. Its IUPAC name is N-[2-methyl-6-(3-oxo-4H-quinoxalin-2-yl)phenyl]benzamide.

Molecular Properties

Compound NameN-[2-methyl-6-(3-oxo-4H-quinoxalin-2-yl)phenyl]benzamide
PubChem CID27187078
Molecular FormulaC22H17N3O2
Molecular Weight355.40 g/mol
Exact Mass355.13
IUPAC NameN-[2-methyl-6-(3-oxo-4H-quinoxalin-2-yl)phenyl]benzamide
SMILESCc1cccc(-c2nc3ccccc3[nH]c2=O)c1NC(=O)c1ccccc1
InChIInChI=1S/C22H17N3O2/c1-14-8-7-11-16(19(14)25-21(26)15-9-3-2-4-10-15)20-22(27)24-18-13-6-5-12-17(18)23-20/h2-13H,1H3,(H,24,27)(H,25,26)
InChIKeyUZAWWUWJMDMYQG-UHFFFAOYSA-N
XLogP4.15
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.40
LogP ≤ 54.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-methoxy-N-[2-(3-oxo-4H-quinoxalin-2-yl)phenyl]benzamide
CID 5019834
4-(1H-benzimidazol-2-yl)-N-(2,6-dimethylphenyl)benzamide
CID 100577552
N-[4-chloro-2-(3-oxo-4H-quinoxalin-2-yl)phenyl]-4-methylbenzamide
CID 100654599
2,4-dimethyl-N-[2-(3-oxo-4H-quinoxalin-2-yl)phenyl]benzamide
CID 100766377
4-methoxy-N-[4-methyl-2-(3-oxo-4H-quinoxalin-2-yl)phenyl]benzamide
CID 7187725
N-(2,6-dimethylphenyl)-3-(3-oxo-4H-quinoxalin-2-yl)propanamide
CID 19164666
N-[4-chloro-2-(3-oxo-4H-quinoxalin-2-yl)phenyl]-4-fluorobenzamide
CID 71901581
N-[2-(6-methyl-3-oxo-4H-quinoxalin-2-yl)phenyl]acetamide
CID 3163691
N-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)benzamide
CID 135725014
ethyl 2-[2-(3-oxo-4H-quinoxalin-2-yl)anilino]acetate
CID 832829
2,2,2-trifluoro-N-[2-(6-methyl-3-oxo-4H-quinoxalin-2-yl)phenyl]acetamide
CID 8007173
N-(2-ethyl-6-methylphenyl)-2,3-diphenylquinoxaline-6-carboxamide
CID 16644401

Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-6-(3-oxo-4H-quinoxalin-2-yl)phenyl]benzamide?
The IUPAC name of N-[2-methyl-6-(3-oxo-4H-quinoxalin-2-yl)phenyl]benzamide (CID 27187078) is N-[2-methyl-6-(3-oxo-4H-quinoxalin-2-yl)phenyl]benzamide.
What is the SMILES notation for N-[2-methyl-6-(3-oxo-4H-quinoxalin-2-yl)phenyl]benzamide?
The canonical SMILES for N-[2-methyl-6-(3-oxo-4H-quinoxalin-2-yl)phenyl]benzamide is Cc1cccc(-c2nc3ccccc3[nH]c2=O)c1NC(=O)c1ccccc1.
What is the InChIKey of N-[2-methyl-6-(3-oxo-4H-quinoxalin-2-yl)phenyl]benzamide?
The InChIKey is UZAWWUWJMDMYQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17N3O2/c1-14-8-7-11-16(19(14)25-21(26)15-9-3-2-4-10-15)20-22(27)24-18-13-6-5-12-17(18)23-20/h2-13H,1H3,(H,24,27)(H,25,26).
What are the key properties of N-[2-methyl-6-(3-oxo-4H-quinoxalin-2-yl)phenyl]benzamide?
N-[2-methyl-6-(3-oxo-4H-quinoxalin-2-yl)phenyl]benzamide has a molecular weight of 355.40 g/mol, XLogP of 4.15, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-6-(3-oxo-4H-quinoxalin-2-yl)phenyl]benzamide is sourced from PubChem (CID 27187078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).