2-(2-oxoquinoxalin-1-yl)-N-propan-2-ylacetamide

C13H15N3O2 — CID 2469439

IUPAC2-(2-oxoquinoxalin-1-yl)-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)Cn1c(=O)cnc2ccccc21
InChIInChI=1S/C13H15N3O2/c1-9(2)15-12(17)8-16-11-6-4-3-5-10(11)14-7-13(16)18/h3-7,9H,8H2,1-2H3,(H,15,17)
InChIKeyUVMZGHNNOZCIHY-UHFFFAOYSA-N
MW245.28 g/mol
LogP0.92
Rot. Bonds3

About 2-(2-oxoquinoxalin-1-yl)-N-propan-2-ylacetamide

2-(2-oxoquinoxalin-1-yl)-N-propan-2-ylacetamide (PubChem CID 2469439) has the molecular formula C13H15N3O2 and a molecular weight of 245.28 g/mol. Its IUPAC name is 2-(2-oxoquinoxalin-1-yl)-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-(2-oxoquinoxalin-1-yl)-N-propan-2-ylacetamide
PubChem CID2469439
Molecular FormulaC13H15N3O2
Molecular Weight245.28 g/mol
Exact Mass245.12
IUPAC Name2-(2-oxoquinoxalin-1-yl)-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)Cn1c(=O)cnc2ccccc21
InChIInChI=1S/C13H15N3O2/c1-9(2)15-12(17)8-16-11-6-4-3-5-10(11)14-7-13(16)18/h3-7,9H,8H2,1-2H3,(H,15,17)
InChIKeyUVMZGHNNOZCIHY-UHFFFAOYSA-N
XLogP0.92
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-oxoquinoxalin-1-yl)-N-propan-2-ylacetamide?
The IUPAC name of 2-(2-oxoquinoxalin-1-yl)-N-propan-2-ylacetamide (CID 2469439) is 2-(2-oxoquinoxalin-1-yl)-N-propan-2-ylacetamide.
What is the SMILES notation for 2-(2-oxoquinoxalin-1-yl)-N-propan-2-ylacetamide?
The canonical SMILES for 2-(2-oxoquinoxalin-1-yl)-N-propan-2-ylacetamide is CC(C)NC(=O)Cn1c(=O)cnc2ccccc21.
What is the InChIKey of 2-(2-oxoquinoxalin-1-yl)-N-propan-2-ylacetamide?
The InChIKey is UVMZGHNNOZCIHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2/c1-9(2)15-12(17)8-16-11-6-4-3-5-10(11)14-7-13(16)18/h3-7,9H,8H2,1-2H3,(H,15,17).
What are the key properties of 2-(2-oxoquinoxalin-1-yl)-N-propan-2-ylacetamide?
2-(2-oxoquinoxalin-1-yl)-N-propan-2-ylacetamide has a molecular weight of 245.28 g/mol, XLogP of 0.92, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-oxoquinoxalin-1-yl)-N-propan-2-ylacetamide is sourced from PubChem (CID 2469439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).