3-(4-cyanophenyl)quinoxaline-5-carboxamide

C16H10N4O — CID 25218518

IUPAC3-(4-cyanophenyl)quinoxaline-5-carboxamide
SMILESN#Cc1ccc(-c2cnc3cccc(C(N)=O)c3n2)cc1
InChIInChI=1S/C16H10N4O/c17-8-10-4-6-11(7-5-10)14-9-19-13-3-1-2-12(16(18)21)15(13)20-14/h1-7,9H,(H2,18,21)
InChIKeyWCZAODKSIJSHQD-UHFFFAOYSA-N
MW274.28 g/mol
LogP2.27
Rot. Bonds2

About 3-(4-cyanophenyl)quinoxaline-5-carboxamide

3-(4-cyanophenyl)quinoxaline-5-carboxamide (PubChem CID 25218518) has the molecular formula C16H10N4O and a molecular weight of 274.28 g/mol. Its IUPAC name is 3-(4-cyanophenyl)quinoxaline-5-carboxamide.

Molecular Properties

Compound Name3-(4-cyanophenyl)quinoxaline-5-carboxamide
PubChem CID25218518
Molecular FormulaC16H10N4O
Molecular Weight274.28 g/mol
Exact Mass274.09
IUPAC Name3-(4-cyanophenyl)quinoxaline-5-carboxamide
SMILESN#Cc1ccc(-c2cnc3cccc(C(N)=O)c3n2)cc1
InChIInChI=1S/C16H10N4O/c17-8-10-4-6-11(7-5-10)14-9-19-13-3-1-2-12(16(18)21)15(13)20-14/h1-7,9H,(H2,18,21)
InChIKeyWCZAODKSIJSHQD-UHFFFAOYSA-N
XLogP2.27
TPSA92.66 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.28
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(4-cyanophenyl)quinoxaline-5-carboxamide 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-methylquinoxaline-5-carboxamide
CID 58369280
phenazine-1-carboxamide
CID 141278918
3-(4-cyanophenyl)-6-oxo-1H-pyridazine-5-carboxamide
CID 131863810
4-(6-aminopyrazin-2-yl)benzonitrile
CID 71303141
6-[4-(5-cyano-2-pyridinyl)phenyl]pyridine-3-carbonitrile
CID 11849612
4-(4-cyanophenyl)-5-methylpyrimidine-2-carboxamide
CID 156843133
2-(4-cyanophenyl)benzoic acid
CID 2757952
3-(2,3,7,8-tetrahydro-1,4-benzodioxin-7-yl)quinoxaline-5-carboxamide
CID 142206396
4-[4-[2-[4-(1,3-benzoxazol-2-yl)phenyl]quinoxalin-6-yl]phenyl]benzonitrile
CID 166850024
2-amino-3-(4-cyanophenoxy)benzamide
CID 115546962
acridine-4-carboxamide
CID 3025721
5-(4-cyanophenyl)-2H-triazole-4-carboxamide
CID 169401962

Frequently Asked Questions

What is the IUPAC name of 3-(4-cyanophenyl)quinoxaline-5-carboxamide?
The IUPAC name of 3-(4-cyanophenyl)quinoxaline-5-carboxamide (CID 25218518) is 3-(4-cyanophenyl)quinoxaline-5-carboxamide.
What is the SMILES notation for 3-(4-cyanophenyl)quinoxaline-5-carboxamide?
The canonical SMILES for 3-(4-cyanophenyl)quinoxaline-5-carboxamide is N#Cc1ccc(-c2cnc3cccc(C(N)=O)c3n2)cc1.
What is the InChIKey of 3-(4-cyanophenyl)quinoxaline-5-carboxamide?
The InChIKey is WCZAODKSIJSHQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10N4O/c17-8-10-4-6-11(7-5-10)14-9-19-13-3-1-2-12(16(18)21)15(13)20-14/h1-7,9H,(H2,18,21).
What are the key properties of 3-(4-cyanophenyl)quinoxaline-5-carboxamide?
3-(4-cyanophenyl)quinoxaline-5-carboxamide has a molecular weight of 274.28 g/mol, XLogP of 2.27, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-cyanophenyl)quinoxaline-5-carboxamide is sourced from PubChem (CID 25218518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).