2,3-dimethyl-N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]quinoxaline-6-carboxamide

C22H20N4O2 — CID 110312475

IUPAC2,3-dimethyl-N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]quinoxaline-6-carboxamide
SMILESCc1nc2ccc(C(=O)NCCc3cc(-c4ccccc4)on3)cc2nc1C
InChIInChI=1S/C22H20N4O2/c1-14-15(2)25-20-12-17(8-9-19(20)24-14)22(27)23-11-10-18-13-21(28-26-18)16-6-4-3-5-7-16/h3-9,12-13H,10-11H2,1-2H3,(H,23,27)
InChIKeyDOFTWJNXGJSZDV-UHFFFAOYSA-N
MW372.43 g/mol
LogP3.87
Rot. Bonds5

About 2,3-dimethyl-N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]quinoxaline-6-carboxamide

2,3-dimethyl-N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]quinoxaline-6-carboxamide (PubChem CID 110312475) has the molecular formula C22H20N4O2 and a molecular weight of 372.43 g/mol. Its IUPAC name is 2,3-dimethyl-N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]quinoxaline-6-carboxamide.

Molecular Properties

Compound Name2,3-dimethyl-N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]quinoxaline-6-carboxamide
PubChem CID110312475
Molecular FormulaC22H20N4O2
Molecular Weight372.43 g/mol
Exact Mass372.16
IUPAC Name2,3-dimethyl-N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]quinoxaline-6-carboxamide
SMILESCc1nc2ccc(C(=O)NCCc3cc(-c4ccccc4)on3)cc2nc1C
InChIInChI=1S/C22H20N4O2/c1-14-15(2)25-20-12-17(8-9-19(20)24-14)22(27)23-11-10-18-13-21(28-26-18)16-6-4-3-5-7-16/h3-9,12-13H,10-11H2,1-2H3,(H,23,27)
InChIKeyDOFTWJNXGJSZDV-UHFFFAOYSA-N
XLogP3.87
TPSA80.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.43
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2,3-dimethyl-N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]quinoxaline-6-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

4-methoxy-N-[2-[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]ethyl]benzamide
CID 110314795
N-[2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]ethyl]-4-methoxybenzamide
CID 110314743
N-[2-[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]ethyl]-3-methylbenzamide
CID 110314788
4-chloro-N-[(5-phenyl-1,2-oxazol-3-yl)methyl]benzamide
CID 16866496
1-phenyl-3-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]urea
CID 110314655
3-acetamido-N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]propanamide
CID 110633970
N-[2-(1H-benzimidazol-2-yl)ethyl]-2,3-dimethylquinoxaline-6-carboxamide
CID 21008897
N-(2-imidazo[2,1-b][1,3]thiazol-6-ylethyl)-2,3-dimethylquinoxaline-6-carboxamide
CID 110661566
2-(4-fluorophenyl)-N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]acetamide
CID 110314644
2,3-diphenyl-N-propylquinoxaline-6-carboxamide
CID 3107662
2,3-dimethyl-N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]quinoxaline-6-carboxamide
CID 110357024
N-[[5-(4-methylphenyl)-1,2-oxazol-3-yl]methyl]-2H-benzotriazole-5-carboxamide
CID 91766494

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]quinoxaline-6-carboxamide?
The IUPAC name of 2,3-dimethyl-N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]quinoxaline-6-carboxamide (CID 110312475) is 2,3-dimethyl-N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]quinoxaline-6-carboxamide.
What is the SMILES notation for 2,3-dimethyl-N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]quinoxaline-6-carboxamide?
The canonical SMILES for 2,3-dimethyl-N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]quinoxaline-6-carboxamide is Cc1nc2ccc(C(=O)NCCc3cc(-c4ccccc4)on3)cc2nc1C.
What is the InChIKey of 2,3-dimethyl-N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]quinoxaline-6-carboxamide?
The InChIKey is DOFTWJNXGJSZDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N4O2/c1-14-15(2)25-20-12-17(8-9-19(20)24-14)22(27)23-11-10-18-13-21(28-26-18)16-6-4-3-5-7-16/h3-9,12-13H,10-11H2,1-2H3,(H,23,27).
What are the key properties of 2,3-dimethyl-N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]quinoxaline-6-carboxamide?
2,3-dimethyl-N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]quinoxaline-6-carboxamide has a molecular weight of 372.43 g/mol, XLogP of 3.87, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]quinoxaline-6-carboxamide is sourced from PubChem (CID 110312475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).