N-(3-methylquinoxalin-5-yl)benzamide

C16H13N3O — CID 141198352

IUPACN-(3-methylquinoxalin-5-yl)benzamide
SMILESCc1cnc2cccc(NC(=O)c3ccccc3)c2n1
InChIInChI=1S/C16H13N3O/c1-11-10-17-13-8-5-9-14(15(13)18-11)19-16(20)12-6-3-2-4-7-12/h2-10H,1H3,(H,19,20)
InChIKeyJLLBJOKAXJTWHZ-UHFFFAOYSA-N
MW263.30 g/mol
LogP3.19
Rot. Bonds2

About N-(3-methylquinoxalin-5-yl)benzamide

N-(3-methylquinoxalin-5-yl)benzamide (PubChem CID 141198352) has the molecular formula C16H13N3O and a molecular weight of 263.30 g/mol. Its IUPAC name is N-(3-methylquinoxalin-5-yl)benzamide.

Molecular Properties

Compound NameN-(3-methylquinoxalin-5-yl)benzamide
PubChem CID141198352
Molecular FormulaC16H13N3O
Molecular Weight263.30 g/mol
Exact Mass263.11
IUPAC NameN-(3-methylquinoxalin-5-yl)benzamide
SMILESCc1cnc2cccc(NC(=O)c3ccccc3)c2n1
InChIInChI=1S/C16H13N3O/c1-11-10-17-13-8-5-9-14(15(13)18-11)19-16(20)12-6-3-2-4-7-12/h2-10H,1H3,(H,19,20)
InChIKeyJLLBJOKAXJTWHZ-UHFFFAOYSA-N
XLogP3.19
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.30
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(3-methylquinoxalin-5-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

Frequently Asked Questions

What is the IUPAC name of N-(3-methylquinoxalin-5-yl)benzamide?
The IUPAC name of N-(3-methylquinoxalin-5-yl)benzamide (CID 141198352) is N-(3-methylquinoxalin-5-yl)benzamide.
What is the SMILES notation for N-(3-methylquinoxalin-5-yl)benzamide?
The canonical SMILES for N-(3-methylquinoxalin-5-yl)benzamide is Cc1cnc2cccc(NC(=O)c3ccccc3)c2n1.
What is the InChIKey of N-(3-methylquinoxalin-5-yl)benzamide?
The InChIKey is JLLBJOKAXJTWHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N3O/c1-11-10-17-13-8-5-9-14(15(13)18-11)19-16(20)12-6-3-2-4-7-12/h2-10H,1H3,(H,19,20).
What are the key properties of N-(3-methylquinoxalin-5-yl)benzamide?
N-(3-methylquinoxalin-5-yl)benzamide has a molecular weight of 263.30 g/mol, XLogP of 3.19, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylquinoxalin-5-yl)benzamide is sourced from PubChem (CID 141198352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).