2-amino-N-benzyl-2-quinoxalin-2-ylacetamide

C17H16N4O — CID 70692377

IUPAC2-amino-N-benzyl-2-quinoxalin-2-ylacetamide
SMILESNC(C(=O)NCc1ccccc1)c1cnc2ccccc2n1
InChIInChI=1S/C17H16N4O/c18-16(17(22)20-10-12-6-2-1-3-7-12)15-11-19-13-8-4-5-9-14(13)21-15/h1-9,11,16H,10,18H2,(H,20,22)
InChIKeySRFUBJNQQKXYKK-UHFFFAOYSA-N
MW292.34 g/mol
LogP1.95
Rot. Bonds4

About 2-amino-N-benzyl-2-quinoxalin-2-ylacetamide

2-amino-N-benzyl-2-quinoxalin-2-ylacetamide (PubChem CID 70692377) has the molecular formula C17H16N4O and a molecular weight of 292.34 g/mol. Its IUPAC name is 2-amino-N-benzyl-2-quinoxalin-2-ylacetamide.

Molecular Properties

Compound Name2-amino-N-benzyl-2-quinoxalin-2-ylacetamide
PubChem CID70692377
Molecular FormulaC17H16N4O
Molecular Weight292.34 g/mol
Exact Mass292.13
IUPAC Name2-amino-N-benzyl-2-quinoxalin-2-ylacetamide
SMILESNC(C(=O)NCc1ccccc1)c1cnc2ccccc2n1
InChIInChI=1S/C17H16N4O/c18-16(17(22)20-10-12-6-2-1-3-7-12)15-11-19-13-8-4-5-9-14(13)21-15/h1-9,11,16H,10,18H2,(H,20,22)
InChIKeySRFUBJNQQKXYKK-UHFFFAOYSA-N
XLogP1.95
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-benzyl-2-quinoxalin-2-ylacetamide?
The IUPAC name of 2-amino-N-benzyl-2-quinoxalin-2-ylacetamide (CID 70692377) is 2-amino-N-benzyl-2-quinoxalin-2-ylacetamide.
What is the SMILES notation for 2-amino-N-benzyl-2-quinoxalin-2-ylacetamide?
The canonical SMILES for 2-amino-N-benzyl-2-quinoxalin-2-ylacetamide is NC(C(=O)NCc1ccccc1)c1cnc2ccccc2n1.
What is the InChIKey of 2-amino-N-benzyl-2-quinoxalin-2-ylacetamide?
The InChIKey is SRFUBJNQQKXYKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O/c18-16(17(22)20-10-12-6-2-1-3-7-12)15-11-19-13-8-4-5-9-14(13)21-15/h1-9,11,16H,10,18H2,(H,20,22).
What are the key properties of 2-amino-N-benzyl-2-quinoxalin-2-ylacetamide?
2-amino-N-benzyl-2-quinoxalin-2-ylacetamide has a molecular weight of 292.34 g/mol, XLogP of 1.95, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-benzyl-2-quinoxalin-2-ylacetamide is sourced from PubChem (CID 70692377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).