2-(3-chloroquinoxalin-2-yl)-2-cyano-N-[1-(4-methoxyphenyl)-2-morpholin-4-ylethyl]acetamide

C24H24ClN5O3 — CID 71559775

IUPAC2-(3-chloroquinoxalin-2-yl)-2-cyano-N-[1-(4-methoxyphenyl)-2-morpholin-4-ylethyl]acetamide
SMILESCOc1ccc(C(CN2CCOCC2)NC(=O)C(C#N)c2nc3ccccc3nc2Cl)cc1
InChIInChI=1S/C24H24ClN5O3/c1-32-17-8-6-16(7-9-17)21(15-30-10-12-33-13-11-30)29-24(31)18(14-26)22-23(25)28-20-5-3-2-4-19(20)27-22/h2-9,18,21H,10-13,15H2,1H3,(H,29,31)
InChIKeyKMLGPWJYMUQKDW-UHFFFAOYSA-N
MW465.94 g/mol
LogP3.09
Rot. Bonds7

About 2-(3-chloroquinoxalin-2-yl)-2-cyano-N-[1-(4-methoxyphenyl)-2-morpholin-4-ylethyl]acetamide

2-(3-chloroquinoxalin-2-yl)-2-cyano-N-[1-(4-methoxyphenyl)-2-morpholin-4-ylethyl]acetamide (PubChem CID 71559775) has the molecular formula C24H24ClN5O3 and a molecular weight of 465.94 g/mol. Its IUPAC name is 2-(3-chloroquinoxalin-2-yl)-2-cyano-N-[1-(4-methoxyphenyl)-2-morpholin-4-ylethyl]acetamide.

Molecular Properties

Compound Name2-(3-chloroquinoxalin-2-yl)-2-cyano-N-[1-(4-methoxyphenyl)-2-morpholin-4-ylethyl]acetamide
PubChem CID71559775
Molecular FormulaC24H24ClN5O3
Molecular Weight465.94 g/mol
Exact Mass465.16
IUPAC Name2-(3-chloroquinoxalin-2-yl)-2-cyano-N-[1-(4-methoxyphenyl)-2-morpholin-4-ylethyl]acetamide
SMILESCOc1ccc(C(CN2CCOCC2)NC(=O)C(C#N)c2nc3ccccc3nc2Cl)cc1
InChIInChI=1S/C24H24ClN5O3/c1-32-17-8-6-16(7-9-17)21(15-30-10-12-33-13-11-30)29-24(31)18(14-26)22-23(25)28-20-5-3-2-4-19(20)27-22/h2-9,18,21H,10-13,15H2,1H3,(H,29,31)
InChIKeyKMLGPWJYMUQKDW-UHFFFAOYSA-N
XLogP3.09
TPSA100.37 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500465.94
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 2-(3-chloroquinoxalin-2-yl)-2-cyano-N-[1-(4-methoxyphenyl)-2-morpholin-4-ylethyl]acetamide 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

2-[3-(azepan-1-yl)quinoxalin-2-yl]-2-cyano-N-[(1S)-1-(4-methoxyphenyl)ethyl]acetamide
CID 71561049
2-(4-methoxyphenoxy)-N-[(1S)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]acetamide
CID 9144531
2-(3-methoxyphenyl)-N-(2-morpholin-4-yl-1-phenylethyl)acetamide
CID 18166755
N-[(1S)-1-(4-methoxyphenyl)propyl]-4-(morpholin-4-ylmethyl)benzamide
CID 28579988
N-[(1S)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]-2-naphthalen-2-yloxyacetamide
CID 9144499
4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-[1-(4-methoxyphenyl)-2-morpholin-4-ylethyl]benzamide
CID 47078883
[(1S)-2-morpholin-4-yl-1-phenylethyl]carbamic acid
CID 68931667
2-methylpropyl (2S)-2-(3-chloroquinoxalin-2-yl)-2-cyanoacetate
CID 7463424
4-methoxy-N-[(1S)-2-morpholin-4-yl-1-phenylethyl]benzenesulfonamide
CID 8844917
1-(4-methoxyphenyl)-3-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]thiourea
CID 8563489
[(2R)-1-methoxypropan-2-yl] (2R)-2-(3-chloroquinoxalin-2-yl)-2-cyanoacetate
CID 7463428
(2R)-2-ethoxy-N-[(1S)-1-(4-methoxyphenyl)-2-(4-methylpiperazin-1-yl)ethyl]propanamide
CID 95151917

Frequently Asked Questions

What is the IUPAC name of 2-(3-chloroquinoxalin-2-yl)-2-cyano-N-[1-(4-methoxyphenyl)-2-morpholin-4-ylethyl]acetamide?
The IUPAC name of 2-(3-chloroquinoxalin-2-yl)-2-cyano-N-[1-(4-methoxyphenyl)-2-morpholin-4-ylethyl]acetamide (CID 71559775) is 2-(3-chloroquinoxalin-2-yl)-2-cyano-N-[1-(4-methoxyphenyl)-2-morpholin-4-ylethyl]acetamide.
What is the SMILES notation for 2-(3-chloroquinoxalin-2-yl)-2-cyano-N-[1-(4-methoxyphenyl)-2-morpholin-4-ylethyl]acetamide?
The canonical SMILES for 2-(3-chloroquinoxalin-2-yl)-2-cyano-N-[1-(4-methoxyphenyl)-2-morpholin-4-ylethyl]acetamide is COc1ccc(C(CN2CCOCC2)NC(=O)C(C#N)c2nc3ccccc3nc2Cl)cc1.
What is the InChIKey of 2-(3-chloroquinoxalin-2-yl)-2-cyano-N-[1-(4-methoxyphenyl)-2-morpholin-4-ylethyl]acetamide?
The InChIKey is KMLGPWJYMUQKDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24ClN5O3/c1-32-17-8-6-16(7-9-17)21(15-30-10-12-33-13-11-30)29-24(31)18(14-26)22-23(25)28-20-5-3-2-4-19(20)27-22/h2-9,18,21H,10-13,15H2,1H3,(H,29,31).
What are the key properties of 2-(3-chloroquinoxalin-2-yl)-2-cyano-N-[1-(4-methoxyphenyl)-2-morpholin-4-ylethyl]acetamide?
2-(3-chloroquinoxalin-2-yl)-2-cyano-N-[1-(4-methoxyphenyl)-2-morpholin-4-ylethyl]acetamide has a molecular weight of 465.94 g/mol, XLogP of 3.09, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chloroquinoxalin-2-yl)-2-cyano-N-[1-(4-methoxyphenyl)-2-morpholin-4-ylethyl]acetamide is sourced from PubChem (CID 71559775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).