N-(3-quinoxalin-2-ylphenyl)propanamide

C17H15N3O — CID 952076

IUPACN-(3-quinoxalin-2-ylphenyl)propanamide
SMILESCCC(=O)Nc1cccc(-c2cnc3ccccc3n2)c1
InChIInChI=1S/C17H15N3O/c1-2-17(21)19-13-7-5-6-12(10-13)16-11-18-14-8-3-4-9-15(14)20-16/h3-11H,2H2,1H3,(H,19,21)
InChIKeyHAUHKAPFHBCCRK-UHFFFAOYSA-N
MW277.33 g/mol
LogP3.65
Rot. Bonds3

About N-(3-quinoxalin-2-ylphenyl)propanamide

N-(3-quinoxalin-2-ylphenyl)propanamide (PubChem CID 952076) has the molecular formula C17H15N3O and a molecular weight of 277.33 g/mol. Its IUPAC name is N-(3-quinoxalin-2-ylphenyl)propanamide.

Molecular Properties

Compound NameN-(3-quinoxalin-2-ylphenyl)propanamide
PubChem CID952076
Molecular FormulaC17H15N3O
Molecular Weight277.33 g/mol
Exact Mass277.12
IUPAC NameN-(3-quinoxalin-2-ylphenyl)propanamide
SMILESCCC(=O)Nc1cccc(-c2cnc3ccccc3n2)c1
InChIInChI=1S/C17H15N3O/c1-2-17(21)19-13-7-5-6-12(10-13)16-11-18-14-8-3-4-9-15(14)20-16/h3-11H,2H2,1H3,(H,19,21)
InChIKeyHAUHKAPFHBCCRK-UHFFFAOYSA-N
XLogP3.65
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.33
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(3-quinoxalin-2-ylphenyl)propanamide 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

5-Methylquinoxaline
CID 61670
8-Aminoquinoline
CID 11359
6-Methylquinoxaline
CID 242567
AG1295
CID 2048
Nps 2390
CID 7067728
3-(2-Quinoxalinyl)aniline
CID 807264
8-Quinolinamine, 4-methyl-
CID 97374
4-tert-butyl-N-(quinolin-3-yl)benzamide
CID 797382
4-butyl-N-(quinolin-3-yl)benzamide
CID 1860395
N-(2-phenylethyl)quinoxaline-2-carboxamide
CID 5300647
1-Methyl-3-quinolin-8-ylurea
CID 250561
4-(Quinoxalin-2-yl)aniline
CID 761862

Frequently Asked Questions

What is the IUPAC name of N-(3-quinoxalin-2-ylphenyl)propanamide?
The IUPAC name of N-(3-quinoxalin-2-ylphenyl)propanamide (CID 952076) is N-(3-quinoxalin-2-ylphenyl)propanamide.
What is the SMILES notation for N-(3-quinoxalin-2-ylphenyl)propanamide?
The canonical SMILES for N-(3-quinoxalin-2-ylphenyl)propanamide is CCC(=O)Nc1cccc(-c2cnc3ccccc3n2)c1.
What is the InChIKey of N-(3-quinoxalin-2-ylphenyl)propanamide?
The InChIKey is HAUHKAPFHBCCRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O/c1-2-17(21)19-13-7-5-6-12(10-13)16-11-18-14-8-3-4-9-15(14)20-16/h3-11H,2H2,1H3,(H,19,21).
What are the key properties of N-(3-quinoxalin-2-ylphenyl)propanamide?
N-(3-quinoxalin-2-ylphenyl)propanamide has a molecular weight of 277.33 g/mol, XLogP of 3.65, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-quinoxalin-2-ylphenyl)propanamide is sourced from PubChem (CID 952076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).