N-(3-chlorophenyl)-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)acetamide

C16H14ClN3O2 — CID 2574371

IUPACN-(3-chlorophenyl)-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)acetamide
SMILESO=C(CN1CC(=O)Nc2ccccc21)Nc1cccc(Cl)c1
InChIInChI=1S/C16H14ClN3O2/c17-11-4-3-5-12(8-11)18-15(21)9-20-10-16(22)19-13-6-1-2-7-14(13)20/h1-8H,9-10H2,(H,18,21)(H,19,22)
InChIKeyBAZUXPLEOTUKMR-UHFFFAOYSA-N
MW315.76 g/mol
LogP2.74
Rot. Bonds3

About N-(3-chlorophenyl)-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)acetamide

N-(3-chlorophenyl)-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)acetamide (PubChem CID 2574371) has the molecular formula C16H14ClN3O2 and a molecular weight of 315.76 g/mol. Its IUPAC name is N-(3-chlorophenyl)-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)acetamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)acetamide
PubChem CID2574371
Molecular FormulaC16H14ClN3O2
Molecular Weight315.76 g/mol
Exact Mass315.08
IUPAC NameN-(3-chlorophenyl)-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)acetamide
SMILESO=C(CN1CC(=O)Nc2ccccc21)Nc1cccc(Cl)c1
InChIInChI=1S/C16H14ClN3O2/c17-11-4-3-5-12(8-11)18-15(21)9-20-10-16(22)19-13-6-1-2-7-14(13)20/h1-8H,9-10H2,(H,18,21)(H,19,22)
InChIKeyBAZUXPLEOTUKMR-UHFFFAOYSA-N
XLogP2.74
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.76
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)acetamide?
The IUPAC name of N-(3-chlorophenyl)-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)acetamide (CID 2574371) is N-(3-chlorophenyl)-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)acetamide.
What is the SMILES notation for N-(3-chlorophenyl)-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)acetamide?
The canonical SMILES for N-(3-chlorophenyl)-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)acetamide is O=C(CN1CC(=O)Nc2ccccc21)Nc1cccc(Cl)c1.
What is the InChIKey of N-(3-chlorophenyl)-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)acetamide?
The InChIKey is BAZUXPLEOTUKMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14ClN3O2/c17-11-4-3-5-12(8-11)18-15(21)9-20-10-16(22)19-13-6-1-2-7-14(13)20/h1-8H,9-10H2,(H,18,21)(H,19,22).
What are the key properties of N-(3-chlorophenyl)-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)acetamide?
N-(3-chlorophenyl)-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)acetamide has a molecular weight of 315.76 g/mol, XLogP of 2.74, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)acetamide is sourced from PubChem (CID 2574371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).