1-(2-chlorophenyl)-3,4-dihydroquinoxalin-2-one

C14H11ClN2O — CID 117006502

IUPAC1-(2-chlorophenyl)-3,4-dihydroquinoxalin-2-one
SMILESO=C1CNc2ccccc2N1c1ccccc1Cl
InChIInChI=1S/C14H11ClN2O/c15-10-5-1-3-7-12(10)17-13-8-4-2-6-11(13)16-9-14(17)18/h1-8,16H,9H2
InChIKeyDTJWPDCGKPSYDM-UHFFFAOYSA-N
MW258.71 g/mol
LogP3.43
Rot. Bonds1

About 1-(2-chlorophenyl)-3,4-dihydroquinoxalin-2-one

1-(2-chlorophenyl)-3,4-dihydroquinoxalin-2-one (PubChem CID 117006502) has the molecular formula C14H11ClN2O and a molecular weight of 258.71 g/mol. Its IUPAC name is 1-(2-chlorophenyl)-3,4-dihydroquinoxalin-2-one.

Molecular Properties

Compound Name1-(2-chlorophenyl)-3,4-dihydroquinoxalin-2-one
PubChem CID117006502
Molecular FormulaC14H11ClN2O
Molecular Weight258.71 g/mol
Exact Mass258.06
IUPAC Name1-(2-chlorophenyl)-3,4-dihydroquinoxalin-2-one
SMILESO=C1CNc2ccccc2N1c1ccccc1Cl
InChIInChI=1S/C14H11ClN2O/c15-10-5-1-3-7-12(10)17-13-8-4-2-6-11(13)16-9-14(17)18/h1-8,16H,9H2
InChIKeyDTJWPDCGKPSYDM-UHFFFAOYSA-N
XLogP3.43
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.71
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-bromophenyl)-3,4-dihydroquinoxalin-2-one
CID 117006515
1-[(2,6-dichlorophenyl)methyl]-3,4-dihydroquinoxalin-2-one
CID 62874448
1-oxido-3,4-dihydroquinoxalin-2-one
CID 87723963
1-(4-methoxyphenyl)-3,4-dihydroquinoxalin-2-one
CID 117006508
1-(3-aminophenyl)-3,4-dihydroquinoxalin-2-one
CID 117030560
1-[3-(aminomethyl)phenyl]-3,4-dihydroquinoxalin-2-one
CID 117030564
N-(2-chlorophenyl)-2-(2-oxo-3,4-dihydroquinoxalin-1-yl)acetamide
CID 94763882
3-(2-chlorophenyl)-1,3-thiazolidine-2,4-dione
CID 4135812
1-but-3-ynyl-3,4-dihydroquinoxalin-2-one
CID 63643833
2-(2-chlorophenyl)pyrazolidin-3-one
CID 83531467
1-(2-chlorophenyl)-3-phenylpyrrolidine-2,5-dione
CID 121238704
3-[(2-chlorophenyl)methyl]-2-sulfanylideneimidazolidin-4-one
CID 2726677

Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorophenyl)-3,4-dihydroquinoxalin-2-one?
The IUPAC name of 1-(2-chlorophenyl)-3,4-dihydroquinoxalin-2-one (CID 117006502) is 1-(2-chlorophenyl)-3,4-dihydroquinoxalin-2-one.
What is the SMILES notation for 1-(2-chlorophenyl)-3,4-dihydroquinoxalin-2-one?
The canonical SMILES for 1-(2-chlorophenyl)-3,4-dihydroquinoxalin-2-one is O=C1CNc2ccccc2N1c1ccccc1Cl.
What is the InChIKey of 1-(2-chlorophenyl)-3,4-dihydroquinoxalin-2-one?
The InChIKey is DTJWPDCGKPSYDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClN2O/c15-10-5-1-3-7-12(10)17-13-8-4-2-6-11(13)16-9-14(17)18/h1-8,16H,9H2.
What are the key properties of 1-(2-chlorophenyl)-3,4-dihydroquinoxalin-2-one?
1-(2-chlorophenyl)-3,4-dihydroquinoxalin-2-one has a molecular weight of 258.71 g/mol, XLogP of 3.43, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chlorophenyl)-3,4-dihydroquinoxalin-2-one is sourced from PubChem (CID 117006502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).