4-propanoyl-1,3-dihydroquinoxalin-2-one

C11H12N2O2 — CID 8551010

IUPAC4-propanoyl-1,3-dihydroquinoxalin-2-one
SMILESCCC(=O)N1CC(=O)Nc2ccccc21
InChIInChI=1S/C11H12N2O2/c1-2-11(15)13-7-10(14)12-8-5-3-4-6-9(8)13/h3-6H,2,7H2,1H3,(H,12,14)
InChIKeyYCDLZRNCWDUXPK-UHFFFAOYSA-N
MW204.23 g/mol
LogP1.38
Rot. Bonds1

About 4-propanoyl-1,3-dihydroquinoxalin-2-one

4-propanoyl-1,3-dihydroquinoxalin-2-one (PubChem CID 8551010) has the molecular formula C11H12N2O2 and a molecular weight of 204.23 g/mol. Its IUPAC name is 4-propanoyl-1,3-dihydroquinoxalin-2-one.

Molecular Properties

Compound Name4-propanoyl-1,3-dihydroquinoxalin-2-one
PubChem CID8551010
Molecular FormulaC11H12N2O2
Molecular Weight204.23 g/mol
Exact Mass204.09
IUPAC Name4-propanoyl-1,3-dihydroquinoxalin-2-one
SMILESCCC(=O)N1CC(=O)Nc2ccccc21
InChIInChI=1S/C11H12N2O2/c1-2-11(15)13-7-10(14)12-8-5-3-4-6-9(8)13/h3-6H,2,7H2,1H3,(H,12,14)
InChIKeyYCDLZRNCWDUXPK-UHFFFAOYSA-N
XLogP1.38
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.23
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-propanoyl-1,3-dihydroquinoxalin-2-one?
The IUPAC name of 4-propanoyl-1,3-dihydroquinoxalin-2-one (CID 8551010) is 4-propanoyl-1,3-dihydroquinoxalin-2-one.
What is the SMILES notation for 4-propanoyl-1,3-dihydroquinoxalin-2-one?
The canonical SMILES for 4-propanoyl-1,3-dihydroquinoxalin-2-one is CCC(=O)N1CC(=O)Nc2ccccc21.
What is the InChIKey of 4-propanoyl-1,3-dihydroquinoxalin-2-one?
The InChIKey is YCDLZRNCWDUXPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2/c1-2-11(15)13-7-10(14)12-8-5-3-4-6-9(8)13/h3-6H,2,7H2,1H3,(H,12,14).
What are the key properties of 4-propanoyl-1,3-dihydroquinoxalin-2-one?
4-propanoyl-1,3-dihydroquinoxalin-2-one has a molecular weight of 204.23 g/mol, XLogP of 1.38, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propanoyl-1,3-dihydroquinoxalin-2-one is sourced from PubChem (CID 8551010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).