2-chloro-N-cyclopropyl-5-(3-morpholin-4-ylquinoxalin-6-yl)benzamide

C22H21ClN4O2 — CID 67035546

IUPAC2-chloro-N-cyclopropyl-5-(3-morpholin-4-ylquinoxalin-6-yl)benzamide
SMILESO=C(NC1CC1)c1cc(-c2ccc3ncc(N4CCOCC4)nc3c2)ccc1Cl
InChIInChI=1S/C22H21ClN4O2/c23-18-5-1-14(11-17(18)22(28)25-16-3-4-16)15-2-6-19-20(12-15)26-21(13-24-19)27-7-9-29-10-8-27/h1-2,5-6,11-13,16H,3-4,7-10H2,(H,25,28)
InChIKeyLESXNKPDGRJDSQ-UHFFFAOYSA-N
MW408.89 g/mol
LogP3.68
Rot. Bonds4

About 2-chloro-N-cyclopropyl-5-(3-morpholin-4-ylquinoxalin-6-yl)benzamide

2-chloro-N-cyclopropyl-5-(3-morpholin-4-ylquinoxalin-6-yl)benzamide (PubChem CID 67035546) has the molecular formula C22H21ClN4O2 and a molecular weight of 408.89 g/mol. Its IUPAC name is 2-chloro-N-cyclopropyl-5-(3-morpholin-4-ylquinoxalin-6-yl)benzamide.

Molecular Properties

Compound Name2-chloro-N-cyclopropyl-5-(3-morpholin-4-ylquinoxalin-6-yl)benzamide
PubChem CID67035546
Molecular FormulaC22H21ClN4O2
Molecular Weight408.89 g/mol
Exact Mass408.14
IUPAC Name2-chloro-N-cyclopropyl-5-(3-morpholin-4-ylquinoxalin-6-yl)benzamide
SMILESO=C(NC1CC1)c1cc(-c2ccc3ncc(N4CCOCC4)nc3c2)ccc1Cl
InChIInChI=1S/C22H21ClN4O2/c23-18-5-1-14(11-17(18)22(28)25-16-3-4-16)15-2-6-19-20(12-15)26-21(13-24-19)27-7-9-29-10-8-27/h1-2,5-6,11-13,16H,3-4,7-10H2,(H,25,28)
InChIKeyLESXNKPDGRJDSQ-UHFFFAOYSA-N
XLogP3.68
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.89
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-chloro-N-cyclopropyl-5-(3-morpholin-4-ylquinoxalin-6-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

Related Compounds

4-(3-morpholin-4-ylquinoxalin-6-yl)benzamide
CID 67036137
1-cyclopropyl-3-[4-(3-morpholin-4-ylquinoxalin-6-yl)phenyl]propan-2-one
CID 158380673
2-fluoro-4-(3-morpholin-4-ylquinoxalin-6-yl)-N-propan-2-ylbenzamide
CID 67035276
2-cyclopropyl-1-[3-(3-morpholin-4-ylquinoxalin-6-yl)phenyl]ethanone
CID 147372579
1-cyclohexyl-2-[4-(3-morpholin-4-ylquinoxalin-6-yl)phenyl]ethanone
CID 159328346
4-[7-(3,5-difluorophenyl)quinoxalin-2-yl]morpholine
CID 67035153
2-methyl-4-(3-morpholin-4-ylquinoxalin-6-yl)aniline
CID 67035841
(2-chloro-3-hydroxyphenyl)-(3-morpholin-4-ylquinoxalin-6-yl)methanone
CID 89478019
4-chloro-3-fluoro-N-[4-fluoro-3-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]benzamide
CID 89443057
2,3-dimethyl-4-(3-morpholin-4-ylquinoxalin-6-yl)benzamide
CID 174653885
4-chloro-3-fluoro-N-[3-(3-morpholin-4-ylquinoxaline-6-carbonyl)phenyl]benzamide
CID 89445010
bis(2-morpholin-4-ylquinoxalin-6-yl)methanone
CID 151491691

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-cyclopropyl-5-(3-morpholin-4-ylquinoxalin-6-yl)benzamide?
The IUPAC name of 2-chloro-N-cyclopropyl-5-(3-morpholin-4-ylquinoxalin-6-yl)benzamide (CID 67035546) is 2-chloro-N-cyclopropyl-5-(3-morpholin-4-ylquinoxalin-6-yl)benzamide.
What is the SMILES notation for 2-chloro-N-cyclopropyl-5-(3-morpholin-4-ylquinoxalin-6-yl)benzamide?
The canonical SMILES for 2-chloro-N-cyclopropyl-5-(3-morpholin-4-ylquinoxalin-6-yl)benzamide is O=C(NC1CC1)c1cc(-c2ccc3ncc(N4CCOCC4)nc3c2)ccc1Cl.
What is the InChIKey of 2-chloro-N-cyclopropyl-5-(3-morpholin-4-ylquinoxalin-6-yl)benzamide?
The InChIKey is LESXNKPDGRJDSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21ClN4O2/c23-18-5-1-14(11-17(18)22(28)25-16-3-4-16)15-2-6-19-20(12-15)26-21(13-24-19)27-7-9-29-10-8-27/h1-2,5-6,11-13,16H,3-4,7-10H2,(H,25,28).
What are the key properties of 2-chloro-N-cyclopropyl-5-(3-morpholin-4-ylquinoxalin-6-yl)benzamide?
2-chloro-N-cyclopropyl-5-(3-morpholin-4-ylquinoxalin-6-yl)benzamide has a molecular weight of 408.89 g/mol, XLogP of 3.68, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-cyclopropyl-5-(3-morpholin-4-ylquinoxalin-6-yl)benzamide is sourced from PubChem (CID 67035546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).