4-(2-naphthalen-1-ylacetyl)-1,3-dihydroquinoxalin-2-one

C20H16N2O2 — CID 20898936

IUPAC4-(2-naphthalen-1-ylacetyl)-1,3-dihydroquinoxalin-2-one
SMILESO=C1CN(C(=O)Cc2cccc3ccccc23)c2ccccc2N1
InChIInChI=1S/C20H16N2O2/c23-19-13-22(18-11-4-3-10-17(18)21-19)20(24)12-15-8-5-7-14-6-1-2-9-16(14)15/h1-11H,12-13H2,(H,21,23)
InChIKeyHEDKYKSBVIDSDZ-UHFFFAOYSA-N
MW316.36 g/mol
LogP3.37
Rot. Bonds2

About 4-(2-naphthalen-1-ylacetyl)-1,3-dihydroquinoxalin-2-one

4-(2-naphthalen-1-ylacetyl)-1,3-dihydroquinoxalin-2-one (PubChem CID 20898936) has the molecular formula C20H16N2O2 and a molecular weight of 316.36 g/mol. Its IUPAC name is 4-(2-naphthalen-1-ylacetyl)-1,3-dihydroquinoxalin-2-one.

Molecular Properties

Compound Name4-(2-naphthalen-1-ylacetyl)-1,3-dihydroquinoxalin-2-one
PubChem CID20898936
Molecular FormulaC20H16N2O2
Molecular Weight316.36 g/mol
Exact Mass316.12
IUPAC Name4-(2-naphthalen-1-ylacetyl)-1,3-dihydroquinoxalin-2-one
SMILESO=C1CN(C(=O)Cc2cccc3ccccc23)c2ccccc2N1
InChIInChI=1S/C20H16N2O2/c23-19-13-22(18-11-4-3-10-17(18)21-19)20(24)12-15-8-5-7-14-6-1-2-9-16(14)15/h1-11H,12-13H2,(H,21,23)
InChIKeyHEDKYKSBVIDSDZ-UHFFFAOYSA-N
XLogP3.37
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.36
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(2-naphthalen-1-ylacetyl)-1,3-dihydroquinoxalin-2-one?
The IUPAC name of 4-(2-naphthalen-1-ylacetyl)-1,3-dihydroquinoxalin-2-one (CID 20898936) is 4-(2-naphthalen-1-ylacetyl)-1,3-dihydroquinoxalin-2-one.
What is the SMILES notation for 4-(2-naphthalen-1-ylacetyl)-1,3-dihydroquinoxalin-2-one?
The canonical SMILES for 4-(2-naphthalen-1-ylacetyl)-1,3-dihydroquinoxalin-2-one is O=C1CN(C(=O)Cc2cccc3ccccc23)c2ccccc2N1.
What is the InChIKey of 4-(2-naphthalen-1-ylacetyl)-1,3-dihydroquinoxalin-2-one?
The InChIKey is HEDKYKSBVIDSDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N2O2/c23-19-13-22(18-11-4-3-10-17(18)21-19)20(24)12-15-8-5-7-14-6-1-2-9-16(14)15/h1-11H,12-13H2,(H,21,23).
What are the key properties of 4-(2-naphthalen-1-ylacetyl)-1,3-dihydroquinoxalin-2-one?
4-(2-naphthalen-1-ylacetyl)-1,3-dihydroquinoxalin-2-one has a molecular weight of 316.36 g/mol, XLogP of 3.37, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-naphthalen-1-ylacetyl)-1,3-dihydroquinoxalin-2-one is sourced from PubChem (CID 20898936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).