2-(3-chlorophenyl)-N-quinoxalin-6-ylacetamide

C16H12ClN3O — CID 110723735

IUPAC2-(3-chlorophenyl)-N-quinoxalin-6-ylacetamide
SMILESO=C(Cc1cccc(Cl)c1)Nc1ccc2nccnc2c1
InChIInChI=1S/C16H12ClN3O/c17-12-3-1-2-11(8-12)9-16(21)20-13-4-5-14-15(10-13)19-7-6-18-14/h1-8,10H,9H2,(H,20,21)
InChIKeyISQOEGFOLBJLIR-UHFFFAOYSA-N
MW297.75 g/mol
LogP3.46
Rot. Bonds3

About 2-(3-chlorophenyl)-N-quinoxalin-6-ylacetamide

2-(3-chlorophenyl)-N-quinoxalin-6-ylacetamide (PubChem CID 110723735) has the molecular formula C16H12ClN3O and a molecular weight of 297.75 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-N-quinoxalin-6-ylacetamide.

Molecular Properties

Compound Name2-(3-chlorophenyl)-N-quinoxalin-6-ylacetamide
PubChem CID110723735
Molecular FormulaC16H12ClN3O
Molecular Weight297.75 g/mol
Exact Mass297.07
IUPAC Name2-(3-chlorophenyl)-N-quinoxalin-6-ylacetamide
SMILESO=C(Cc1cccc(Cl)c1)Nc1ccc2nccnc2c1
InChIInChI=1S/C16H12ClN3O/c17-12-3-1-2-11(8-12)9-16(21)20-13-4-5-14-15(10-13)19-7-6-18-14/h1-8,10H,9H2,(H,20,21)
InChIKeyISQOEGFOLBJLIR-UHFFFAOYSA-N
XLogP3.46
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.75
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(chloromethyl)phenyl]-2-(3-chlorophenyl)acetamide
CID 113270904
2-(3-chlorophenyl)-N-pyrazin-2-ylacetamide
CID 127120451
2-(3-chlorophenyl)-N-(1,2-dimethylbenzimidazol-5-yl)acetamide
CID 110779237
2-(2-methylphenyl)-N-quinoxalin-6-ylacetamide
CID 110723730
4-[[2-(3-chlorophenyl)acetyl]amino]benzamide
CID 56922735
methyl 3-[[2-(3-chlorophenyl)acetyl]amino]benzoate
CID 62505130
N-[4-[[2-(3-chlorophenyl)acetyl]amino]phenyl]-2-cyanoacetamide
CID 108922593
2-(3-chlorophenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
CID 56923008
N-(6-chloro-5-methyl-3-pyridinyl)-2-(3-chlorophenyl)acetamide
CID 103745271
N-(3-chlorophenyl)-2-(3-methylphenyl)acetamide
CID 9497443
4-chloro-N-quinoxalin-6-ylpyridine-2-carboxamide
CID 47254903
N-[4-(3-bromoanilino)quinazolin-6-yl]-2-(3-chlorophenyl)acetamide
CID 174705931

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-N-quinoxalin-6-ylacetamide?
The IUPAC name of 2-(3-chlorophenyl)-N-quinoxalin-6-ylacetamide (CID 110723735) is 2-(3-chlorophenyl)-N-quinoxalin-6-ylacetamide.
What is the SMILES notation for 2-(3-chlorophenyl)-N-quinoxalin-6-ylacetamide?
The canonical SMILES for 2-(3-chlorophenyl)-N-quinoxalin-6-ylacetamide is O=C(Cc1cccc(Cl)c1)Nc1ccc2nccnc2c1.
What is the InChIKey of 2-(3-chlorophenyl)-N-quinoxalin-6-ylacetamide?
The InChIKey is ISQOEGFOLBJLIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12ClN3O/c17-12-3-1-2-11(8-12)9-16(21)20-13-4-5-14-15(10-13)19-7-6-18-14/h1-8,10H,9H2,(H,20,21).
What are the key properties of 2-(3-chlorophenyl)-N-quinoxalin-6-ylacetamide?
2-(3-chlorophenyl)-N-quinoxalin-6-ylacetamide has a molecular weight of 297.75 g/mol, XLogP of 3.46, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-N-quinoxalin-6-ylacetamide is sourced from PubChem (CID 110723735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).