(2R)-N-(3,5-dichlorophenyl)-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)-2-phenylacetamide

C22H17Cl2N3O2 — CID 2476808

IUPAC(2R)-N-(3,5-dichlorophenyl)-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)-2-phenylacetamide
SMILESO=C1CN([C@@H](C(=O)Nc2cc(Cl)cc(Cl)c2)c2ccccc2)c2ccccc2N1
InChIInChI=1S/C22H17Cl2N3O2/c23-15-10-16(24)12-17(11-15)25-22(29)21(14-6-2-1-3-7-14)27-13-20(28)26-18-8-4-5-9-19(18)27/h1-12,21H,13H2,(H,25,29)(H,26,28)/t21-/m1/s1
InChIKeyFMHLIJKKZLMBLC-OAQYLSRUSA-N
MW426.30 g/mol
LogP5.13
Rot. Bonds4

About (2R)-N-(3,5-dichlorophenyl)-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)-2-phenylacetamide

(2R)-N-(3,5-dichlorophenyl)-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)-2-phenylacetamide (PubChem CID 2476808) has the molecular formula C22H17Cl2N3O2 and a molecular weight of 426.30 g/mol. Its IUPAC name is (2R)-N-(3,5-dichlorophenyl)-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)-2-phenylacetamide.

Molecular Properties

Compound Name(2R)-N-(3,5-dichlorophenyl)-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)-2-phenylacetamide
PubChem CID2476808
Molecular FormulaC22H17Cl2N3O2
Molecular Weight426.30 g/mol
Exact Mass425.07
IUPAC Name(2R)-N-(3,5-dichlorophenyl)-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)-2-phenylacetamide
SMILESO=C1CN([C@@H](C(=O)Nc2cc(Cl)cc(Cl)c2)c2ccccc2)c2ccccc2N1
InChIInChI=1S/C22H17Cl2N3O2/c23-15-10-16(24)12-17(11-15)25-22(29)21(14-6-2-1-3-7-14)27-13-20(28)26-18-8-4-5-9-19(18)27/h1-12,21H,13H2,(H,25,29)(H,26,28)/t21-/m1/s1
InChIKeyFMHLIJKKZLMBLC-OAQYLSRUSA-N
XLogP5.13
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500426.30
LogP ≤ 55.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (2R)-N-(3,5-dichlorophenyl)-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)-2-phenylacetamide 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

(2S)-N-(3,5-dichlorophenyl)-2-phenyl-2-piperidin-1-ylacetamide
CID 2563626
4-(1-phenylethyl)-1,3-dihydroquinoxalin-2-one
CID 117006573
(2S)-N-(3,5-dichlorophenyl)-2-(3-oxopiperazin-1-ium-1-yl)-2-phenylacetamide
CID 2450954
(2S)-N-(3,5-dichlorophenyl)-2-[(3S)-3-methylpiperidin-1-yl]-2-phenylacetamide
CID 51673367
2-(8-chloro-2,5-dioxo-1,3-dihydro-1,4-benzodiazepin-4-yl)-N-(3,8-dimethyl-5-propan-2-ylazulen-1-yl)-2-phenylacetamide
CID 122376550
N-(3-chloro-4-fluorophenyl)-3-oxo-2,4-dihydroquinoxaline-1-carboxamide
CID 84524812
2-(3-oxo-2,4-dihydroquinoxalin-1-yl)propanehydrazide
CID 63571192
(2S)-N-(3-chloro-4-methylphenyl)-2-(3-oxopiperazin-1-yl)-2-phenylacetamide
CID 2657012
N-(3,5-dichlorophenyl)-2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-phenylacetamide
CID 4966840
(2S)-2-(5-oxo-1,4-diazepan-1-yl)-N,2-diphenylacetamide
CID 94537942
(2R)-N-(2,5-dichlorophenyl)-2-(3-oxo-1H-isoindol-2-yl)-2-phenylacetamide
CID 92688450
N-(3,5-dichlorophenyl)-2-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]-2-phenylacetamide
CID 3284105

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(3,5-dichlorophenyl)-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)-2-phenylacetamide?
The IUPAC name of (2R)-N-(3,5-dichlorophenyl)-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)-2-phenylacetamide (CID 2476808) is (2R)-N-(3,5-dichlorophenyl)-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)-2-phenylacetamide.
What is the SMILES notation for (2R)-N-(3,5-dichlorophenyl)-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)-2-phenylacetamide?
The canonical SMILES for (2R)-N-(3,5-dichlorophenyl)-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)-2-phenylacetamide is O=C1CN([C@@H](C(=O)Nc2cc(Cl)cc(Cl)c2)c2ccccc2)c2ccccc2N1.
What is the InChIKey of (2R)-N-(3,5-dichlorophenyl)-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)-2-phenylacetamide?
The InChIKey is FMHLIJKKZLMBLC-OAQYLSRUSA-N. The full InChI is InChI=1S/C22H17Cl2N3O2/c23-15-10-16(24)12-17(11-15)25-22(29)21(14-6-2-1-3-7-14)27-13-20(28)26-18-8-4-5-9-19(18)27/h1-12,21H,13H2,(H,25,29)(H,26,28)/t21-/m1/s1.
What are the key properties of (2R)-N-(3,5-dichlorophenyl)-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)-2-phenylacetamide?
(2R)-N-(3,5-dichlorophenyl)-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)-2-phenylacetamide has a molecular weight of 426.30 g/mol, XLogP of 5.13, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(3,5-dichlorophenyl)-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)-2-phenylacetamide is sourced from PubChem (CID 2476808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).