4-ethyl-6-hydroxyspiro[1H-quinoxaline-3,1'-cyclohexane]-2-one

C15H20N2O2 — CID 115098187

IUPAC4-ethyl-6-hydroxyspiro[1H-quinoxaline-3,1'-cyclohexane]-2-one
SMILESCCN1c2cc(O)ccc2NC(=O)C12CCCCC2
InChIInChI=1S/C15H20N2O2/c1-2-17-13-10-11(18)6-7-12(13)16-14(19)15(17)8-4-3-5-9-15/h6-7,10,18H,2-5,8-9H2,1H3,(H,16,19)
InChIKeyWSFQRPKHEMVFMI-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.87
Rot. Bonds1

About 4-ethyl-6-hydroxyspiro[1H-quinoxaline-3,1'-cyclohexane]-2-one

4-ethyl-6-hydroxyspiro[1H-quinoxaline-3,1'-cyclohexane]-2-one (PubChem CID 115098187) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 4-ethyl-6-hydroxyspiro[1H-quinoxaline-3,1'-cyclohexane]-2-one.

Molecular Properties

Compound Name4-ethyl-6-hydroxyspiro[1H-quinoxaline-3,1'-cyclohexane]-2-one
PubChem CID115098187
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name4-ethyl-6-hydroxyspiro[1H-quinoxaline-3,1'-cyclohexane]-2-one
SMILESCCN1c2cc(O)ccc2NC(=O)C12CCCCC2
InChIInChI=1S/C15H20N2O2/c1-2-17-13-10-11(18)6-7-12(13)16-14(19)15(17)8-4-3-5-9-15/h6-7,10,18H,2-5,8-9H2,1H3,(H,16,19)
InChIKeyWSFQRPKHEMVFMI-UHFFFAOYSA-N
XLogP2.87
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroquinone', 'substructure': 'N/A'}

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Related Compounds

4-ethyl-6-fluorospiro[1H-quinoxaline-3,1'-cyclohexane]-2-one
CID 115098183
7-hydroxy-5-methylspiro[1,4-dihydro-1,5-benzodiazepine-3,1'-cyclopentane]-2-one
CID 115099669
4-ethyl-5-methylspiro[1H-quinoxaline-3,1'-cyclopentane]-2-one
CID 115097630
4-ethyl-5-methoxyspiro[1H-quinoxaline-3,1'-cyclohexane]-2-one
CID 115097958
4-ethyl-8-fluorospiro[1H-quinoxaline-3,1'-cyclohexane]-2-one
CID 115098036
5-bromo-4-ethylspiro[1H-quinoxaline-3,1'-cyclobutane]-2-one
CID 115097278
5-chloro-4-ethylspiro[1H-quinoxaline-3,1'-cyclobutane]-2-one
CID 115097277
6-chloro-4-propan-2-ylspiro[1H-quinoxaline-3,1'-cyclohexane]-2-one
CID 115098186
4-ethyl-5-fluorospiro[1H-quinoxaline-3,1'-cyclopropane]-2-one
CID 115096911
1-ethyl-7-hydroxy-3,3-dimethyl-5H-1,5-benzodiazepine-2,4-dione
CID 50943220
4-ethyl-2,2-dimethyl-1,3-dihydroquinoxalin-6-ol
CID 115095246
3-tert-butyl-1-ethyl-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 64903246

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-6-hydroxyspiro[1H-quinoxaline-3,1'-cyclohexane]-2-one?
The IUPAC name of 4-ethyl-6-hydroxyspiro[1H-quinoxaline-3,1'-cyclohexane]-2-one (CID 115098187) is 4-ethyl-6-hydroxyspiro[1H-quinoxaline-3,1'-cyclohexane]-2-one.
What is the SMILES notation for 4-ethyl-6-hydroxyspiro[1H-quinoxaline-3,1'-cyclohexane]-2-one?
The canonical SMILES for 4-ethyl-6-hydroxyspiro[1H-quinoxaline-3,1'-cyclohexane]-2-one is CCN1c2cc(O)ccc2NC(=O)C12CCCCC2.
What is the InChIKey of 4-ethyl-6-hydroxyspiro[1H-quinoxaline-3,1'-cyclohexane]-2-one?
The InChIKey is WSFQRPKHEMVFMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-2-17-13-10-11(18)6-7-12(13)16-14(19)15(17)8-4-3-5-9-15/h6-7,10,18H,2-5,8-9H2,1H3,(H,16,19).
What are the key properties of 4-ethyl-6-hydroxyspiro[1H-quinoxaline-3,1'-cyclohexane]-2-one?
4-ethyl-6-hydroxyspiro[1H-quinoxaline-3,1'-cyclohexane]-2-one has a molecular weight of 260.34 g/mol, XLogP of 2.87, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-6-hydroxyspiro[1H-quinoxaline-3,1'-cyclohexane]-2-one is sourced from PubChem (CID 115098187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).