N-(3,5-dichlorophenyl)-2-[(2R)-6,7-dimethyl-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl]acetamide

C18H17Cl2N3O2 — CID 1093116

About N-(3,5-dichlorophenyl)-2-[(2R)-6,7-dimethyl-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl]acetamide

N-(3,5-dichlorophenyl)-2-[(2R)-6,7-dimethyl-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl]acetamide (PubChem CID 1093116) has the molecular formula C18H17Cl2N3O2 and a molecular weight of 378.26 g/mol. Its IUPAC name is N-(3,5-dichlorophenyl)-2-[(2R)-6,7-dimethyl-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl]acetamide.

Molecular Properties

• Compound Name: N-(3,5-dichlorophenyl)-2-[(2R)-6,7-dimethyl-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl]acetamide
• PubChem CID: 1093116
• Molecular Formula: C18H17Cl2N3O2
• Molecular Weight: 378.26 g/mol
• Exact Mass: 377.07
• IUPAC Name: N-(3,5-dichlorophenyl)-2-[(2R)-6,7-dimethyl-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl]acetamide
• SMILES: Cc1cc2c(cc1C)N[C@H](CC(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)N2
• InChI: InChI=1S/C18H17Cl2N3O2/c1-9-3-14-15(4-10(9)2)23-18(25)16(22-14)8-17(24)21-13-6-11(19)5-12(20)7-13/h3-7,16,22H,8H2,1-2H3,(H,21,24)(H,23,25)/t16-/m1/s1
• InChIKey: NYLFNBJUXUYJRF-MRXNPFEDSA-N
• XLogP: 4.37
• TPSA: 70.23 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 3
• Rotatable Bonds: 3
• Heavy Atoms: 25
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	378.26
LogP ≤ 5	4.37
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dichlorophenyl)-2-[(2R)-6,7-dimethyl-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl]acetamide?

The IUPAC name of N-(3,5-dichlorophenyl)-2-[(2R)-6,7-dimethyl-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl]acetamide (CID 1093116) is N-(3,5-dichlorophenyl)-2-[(2R)-6,7-dimethyl-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl]acetamide.

What is the SMILES notation for N-(3,5-dichlorophenyl)-2-[(2R)-6,7-dimethyl-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl]acetamide?

The canonical SMILES for N-(3,5-dichlorophenyl)-2-[(2R)-6,7-dimethyl-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl]acetamide is Cc1cc2c(cc1C)N[C@H](CC(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)N2.

What is the InChIKey of N-(3,5-dichlorophenyl)-2-[(2R)-6,7-dimethyl-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl]acetamide?

The InChIKey is NYLFNBJUXUYJRF-MRXNPFEDSA-N. The full InChI is InChI=1S/C18H17Cl2N3O2/c1-9-3-14-15(4-10(9)2)23-18(25)16(22-14)8-17(24)21-13-6-11(19)5-12(20)7-13/h3-7,16,22H,8H2,1-2H3,(H,21,24)(H,23,25)/t16-/m1/s1.

What are the key properties of N-(3,5-dichlorophenyl)-2-[(2R)-6,7-dimethyl-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl]acetamide?

N-(3,5-dichlorophenyl)-2-[(2R)-6,7-dimethyl-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl]acetamide has a molecular weight of 378.26 g/mol, XLogP of 4.37, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for N-(3,5-dichlorophenyl)-2-[(2R)-6,7-dimethyl-3-oxo-2,4-dihydro-1H-quinoxalin-2-yl]acetamide is sourced from PubChem (CID 1093116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).