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

C15H20N2O — CID 62874787

IUPAC1-(cyclohexylmethyl)-3,4-dihydroquinoxalin-2-one
SMILESO=C1CNc2ccccc2N1CC1CCCCC1
InChIInChI=1S/C15H20N2O/c18-15-10-16-13-8-4-5-9-14(13)17(15)11-12-6-2-1-3-7-12/h4-5,8-9,12,16H,1-3,6-7,10-11H2
InChIKeyAWMNRGWENNPMBX-UHFFFAOYSA-N
MW244.34 g/mol
LogP3.03
Rot. Bonds2

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

1-(cyclohexylmethyl)-3,4-dihydroquinoxalin-2-one (PubChem CID 62874787) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 1-(cyclohexylmethyl)-3,4-dihydroquinoxalin-2-one.

Molecular Properties

Compound Name1-(cyclohexylmethyl)-3,4-dihydroquinoxalin-2-one
PubChem CID62874787
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name1-(cyclohexylmethyl)-3,4-dihydroquinoxalin-2-one
SMILESO=C1CNc2ccccc2N1CC1CCCCC1
InChIInChI=1S/C15H20N2O/c18-15-10-16-13-8-4-5-9-14(13)17(15)11-12-6-2-1-3-7-12/h4-5,8-9,12,16H,1-3,6-7,10-11H2
InChIKeyAWMNRGWENNPMBX-UHFFFAOYSA-N
XLogP3.03
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(piperidin-2-ylmethyl)-3,4-dihydroquinoxalin-2-one
CID 117030559
1-(oxan-4-ylmethyl)-3,4-dihydro-1,4-benzodiazepine-2,5-dione
CID 79909619
1-[2-(oxolan-2-yl)ethyl]-3,4-dihydroquinoxalin-2-one
CID 65166169
2-[2-(2-oxo-3,4-dihydroquinoxalin-1-yl)ethyl]isoindole-1,3-dione
CID 94763938
1-but-3-ynyl-3,4-dihydroquinoxalin-2-one
CID 63643833
1-(2-methylprop-2-enyl)-3,4-dihydroquinoxalin-2-one
CID 82156911
4-(2-oxo-3,4-dihydroquinoxalin-1-yl)butanenitrile
CID 62876473
4-(cyclopentylmethyl)-3-methyl-2,3-dihydro-1H-quinoxaline
CID 115318348
1-(oxolan-3-ylmethyl)-3,4-dihydro-1,4-benzodiazepine-2,5-dione
CID 79909620
1-(cyclobutylmethyl)spiro[4H-quinoxaline-3,4'-piperidine]-2-one
CID 70740820
1-[2-(1-methylimidazol-2-yl)ethyl]-3,4-dihydroquinoxalin-2-one
CID 114531269
3-[2-[4-(cyclopropylmethyl)-2,3-dihydroquinoxalin-1-yl]ethyl]imidazolidine-2,4-dione
CID 71867375

Frequently Asked Questions

What is the IUPAC name of 1-(cyclohexylmethyl)-3,4-dihydroquinoxalin-2-one?
The IUPAC name of 1-(cyclohexylmethyl)-3,4-dihydroquinoxalin-2-one (CID 62874787) is 1-(cyclohexylmethyl)-3,4-dihydroquinoxalin-2-one.
What is the SMILES notation for 1-(cyclohexylmethyl)-3,4-dihydroquinoxalin-2-one?
The canonical SMILES for 1-(cyclohexylmethyl)-3,4-dihydroquinoxalin-2-one is O=C1CNc2ccccc2N1CC1CCCCC1.
What is the InChIKey of 1-(cyclohexylmethyl)-3,4-dihydroquinoxalin-2-one?
The InChIKey is AWMNRGWENNPMBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c18-15-10-16-13-8-4-5-9-14(13)17(15)11-12-6-2-1-3-7-12/h4-5,8-9,12,16H,1-3,6-7,10-11H2.
What are the key properties of 1-(cyclohexylmethyl)-3,4-dihydroquinoxalin-2-one?
1-(cyclohexylmethyl)-3,4-dihydroquinoxalin-2-one has a molecular weight of 244.34 g/mol, XLogP of 3.03, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclohexylmethyl)-3,4-dihydroquinoxalin-2-one is sourced from PubChem (CID 62874787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).