cyclohexen-1-yl(quinoxalin-5-yl)methanone

C15H14N2O — CID 106656102

IUPACcyclohexen-1-yl(quinoxalin-5-yl)methanone
SMILESO=C(C1=CCCCC1)c1cccc2nccnc12
InChIInChI=1S/C15H14N2O/c18-15(11-5-2-1-3-6-11)12-7-4-8-13-14(12)17-10-9-16-13/h4-5,7-10H,1-3,6H2
InChIKeyHCVDHGRJSPEKBA-UHFFFAOYSA-N
MW238.29 g/mol
LogP3.31
Rot. Bonds2

About cyclohexen-1-yl(quinoxalin-5-yl)methanone

cyclohexen-1-yl(quinoxalin-5-yl)methanone (PubChem CID 106656102) has the molecular formula C15H14N2O and a molecular weight of 238.29 g/mol. Its IUPAC name is cyclohexen-1-yl(quinoxalin-5-yl)methanone.

Molecular Properties

Compound Namecyclohexen-1-yl(quinoxalin-5-yl)methanone
PubChem CID106656102
Molecular FormulaC15H14N2O
Molecular Weight238.29 g/mol
Exact Mass238.11
IUPAC Namecyclohexen-1-yl(quinoxalin-5-yl)methanone
SMILESO=C(C1=CCCCC1)c1cccc2nccnc12
InChIInChI=1S/C15H14N2O/c18-15(11-5-2-1-3-6-11)12-7-4-8-13-14(12)17-10-9-16-13/h4-5,7-10H,1-3,6H2
InChIKeyHCVDHGRJSPEKBA-UHFFFAOYSA-N
XLogP3.31
TPSA42.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[(1E)-cycloocten-1-yl]-quinoxalin-5-ylmethanone
CID 106655939
[(1E)-cycloocten-1-yl]-quinolin-4-ylmethanone
CID 106655937
cyclohexen-1-yl(pyrimidin-2-yl)methanone
CID 106651764
[(1E)-cycloocten-1-yl]-quinoxalin-6-ylmethanone
CID 106651853
cyclohexen-1-yl-(2-methylphenyl)methanone
CID 62078822
(2-amino-3-pyridinyl)-(cyclopenten-1-yl)methanone
CID 103448139
[(1E)-cycloocten-1-yl]-(2-methylphenyl)methanone
CID 106651753
(2-bromo-3-methylphenyl)-[(1E)-cycloocten-1-yl]methanone
CID 107984675
cyclopenten-1-yl-(2,3-dimethylphenyl)methanone
CID 62080312
1-benzothiophen-7-yl(cyclohexen-1-yl)methanone
CID 103450051
cyclohepten-1-yl(quinoxalin-2-yl)methanone
CID 107356849
cyclohepten-1-yl-(3-fluoro-4-pyridinyl)methanone
CID 103450510

Frequently Asked Questions

What is the IUPAC name of cyclohexen-1-yl(quinoxalin-5-yl)methanone?
The IUPAC name of cyclohexen-1-yl(quinoxalin-5-yl)methanone (CID 106656102) is cyclohexen-1-yl(quinoxalin-5-yl)methanone.
What is the SMILES notation for cyclohexen-1-yl(quinoxalin-5-yl)methanone?
The canonical SMILES for cyclohexen-1-yl(quinoxalin-5-yl)methanone is O=C(C1=CCCCC1)c1cccc2nccnc12.
What is the InChIKey of cyclohexen-1-yl(quinoxalin-5-yl)methanone?
The InChIKey is HCVDHGRJSPEKBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O/c18-15(11-5-2-1-3-6-11)12-7-4-8-13-14(12)17-10-9-16-13/h4-5,7-10H,1-3,6H2.
What are the key properties of cyclohexen-1-yl(quinoxalin-5-yl)methanone?
cyclohexen-1-yl(quinoxalin-5-yl)methanone has a molecular weight of 238.29 g/mol, XLogP of 3.31, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexen-1-yl(quinoxalin-5-yl)methanone is sourced from PubChem (CID 106656102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).