1-[2-(oxolan-2-yl)ethyl]-3,4-dihydroquinoxalin-2-one

C14H18N2O2 — CID 65166169

IUPAC1-[2-(oxolan-2-yl)ethyl]-3,4-dihydroquinoxalin-2-one
SMILESO=C1CNc2ccccc2N1CCC1CCCO1
InChIInChI=1S/C14H18N2O2/c17-14-10-15-12-5-1-2-6-13(12)16(14)8-7-11-4-3-9-18-11/h1-2,5-6,11,15H,3-4,7-10H2
InChIKeyANETUYPWSPIWGD-UHFFFAOYSA-N
MW246.31 g/mol
LogP2.01
Rot. Bonds3

About 1-[2-(oxolan-2-yl)ethyl]-3,4-dihydroquinoxalin-2-one

1-[2-(oxolan-2-yl)ethyl]-3,4-dihydroquinoxalin-2-one (PubChem CID 65166169) has the molecular formula C14H18N2O2 and a molecular weight of 246.31 g/mol. Its IUPAC name is 1-[2-(oxolan-2-yl)ethyl]-3,4-dihydroquinoxalin-2-one.

Molecular Properties

Compound Name1-[2-(oxolan-2-yl)ethyl]-3,4-dihydroquinoxalin-2-one
PubChem CID65166169
Molecular FormulaC14H18N2O2
Molecular Weight246.31 g/mol
Exact Mass246.14
IUPAC Name1-[2-(oxolan-2-yl)ethyl]-3,4-dihydroquinoxalin-2-one
SMILESO=C1CNc2ccccc2N1CCC1CCCO1
InChIInChI=1S/C14H18N2O2/c17-14-10-15-12-5-1-2-6-13(12)16(14)8-7-11-4-3-9-18-11/h1-2,5-6,11,15H,3-4,7-10H2
InChIKeyANETUYPWSPIWGD-UHFFFAOYSA-N
XLogP2.01
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[3-(oxolan-2-yl)propyl]-4,5-dihydro-3H-1,4-benzodiazepin-2-one
CID 65362289
3-[[(2S)-oxolan-2-yl]methyl]-2-sulfanylideneimidazolidin-4-one
CID 7026051
5-[3-(oxolan-2-yl)propyl]-1,2,3,4-tetrahydro-1,5-benzodiazepine
CID 65170568
1-(cyclohexylmethyl)-3,4-dihydroquinoxalin-2-one
CID 62874787
1-[3-(oxolan-2-yl)propyl]indole-2,3-dione
CID 65162625
1-[2-(oxolan-2-yl)ethyl]benzo[cd]indol-2-one
CID 116619003
4-(2-oxo-3,4-dihydroquinoxalin-1-yl)butanenitrile
CID 62876473
3-(oxan-2-ylmethyl)imidazolidine-2,4-dione
CID 103601172
2-(2-fluorophenyl)-3-[2-(oxolan-2-yl)ethyl]imidazolidin-4-one
CID 83249203
1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-3,4-dihydroquinoxalin-2-one
CID 104566166
1-[2-(oxolan-2-yl)ethyl]-2,3-dihydroindole-2-carboxylic acid
CID 80566587
3-methyl-1-[3-(oxolan-2-yl)propyl]piperazine-2,6-dione
CID 66076059

Frequently Asked Questions

What is the IUPAC name of 1-[2-(oxolan-2-yl)ethyl]-3,4-dihydroquinoxalin-2-one?
The IUPAC name of 1-[2-(oxolan-2-yl)ethyl]-3,4-dihydroquinoxalin-2-one (CID 65166169) is 1-[2-(oxolan-2-yl)ethyl]-3,4-dihydroquinoxalin-2-one.
What is the SMILES notation for 1-[2-(oxolan-2-yl)ethyl]-3,4-dihydroquinoxalin-2-one?
The canonical SMILES for 1-[2-(oxolan-2-yl)ethyl]-3,4-dihydroquinoxalin-2-one is O=C1CNc2ccccc2N1CCC1CCCO1.
What is the InChIKey of 1-[2-(oxolan-2-yl)ethyl]-3,4-dihydroquinoxalin-2-one?
The InChIKey is ANETUYPWSPIWGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2/c17-14-10-15-12-5-1-2-6-13(12)16(14)8-7-11-4-3-9-18-11/h1-2,5-6,11,15H,3-4,7-10H2.
What are the key properties of 1-[2-(oxolan-2-yl)ethyl]-3,4-dihydroquinoxalin-2-one?
1-[2-(oxolan-2-yl)ethyl]-3,4-dihydroquinoxalin-2-one has a molecular weight of 246.31 g/mol, XLogP of 2.01, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(oxolan-2-yl)ethyl]-3,4-dihydroquinoxalin-2-one is sourced from PubChem (CID 65166169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).