1-cyclohexyl-2-methylsulfonylimidazole

C10H16N2O2S — CID 82128342

IUPAC1-cyclohexyl-2-methylsulfonylimidazole
SMILESCS(=O)(=O)c1nccn1C1CCCCC1
InChIInChI=1S/C10H16N2O2S/c1-15(13,14)10-11-7-8-12(10)9-5-3-2-4-6-9/h7-9H,2-6H2,1H3
InChIKeyQVMUUZSKACPPBC-UHFFFAOYSA-N
MW228.32 g/mol
LogP1.79
Rot. Bonds2

About 1-cyclohexyl-2-methylsulfonylimidazole

1-cyclohexyl-2-methylsulfonylimidazole (PubChem CID 82128342) has the molecular formula C10H16N2O2S and a molecular weight of 228.32 g/mol. Its IUPAC name is 1-cyclohexyl-2-methylsulfonylimidazole.

Molecular Properties

Compound Name1-cyclohexyl-2-methylsulfonylimidazole
PubChem CID82128342
Molecular FormulaC10H16N2O2S
Molecular Weight228.32 g/mol
Exact Mass228.09
IUPAC Name1-cyclohexyl-2-methylsulfonylimidazole
SMILESCS(=O)(=O)c1nccn1C1CCCCC1
InChIInChI=1S/C10H16N2O2S/c1-15(13,14)10-11-7-8-12(10)9-5-3-2-4-6-9/h7-9H,2-6H2,1H3
InChIKeyQVMUUZSKACPPBC-UHFFFAOYSA-N
XLogP1.79
TPSA51.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.32
LogP ≤ 51.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 130635620
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1-cycloheptylimidazole-2-carboxylic acid
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1-(1-cyclohexylimidazol-2-yl)ethanol
CID 169132500
1-(thiolan-3-yl)imidazole-2-sulfonyl chloride
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CID 22585437
trans-(1R,3R)-3-[2-(4-methylsulfonylphenyl)imidazol-1-yl]cyclohexan-1-amine
CID 154566008
1-cyclohexyl-N-(3-methylbutan-2-yl)imidazol-2-amine
CID 106554339
1-(1-cyclohexylimidazol-2-yl)-3,5-dimethylpiperazine
CID 106552732
1-[1-(1-cyclohexylimidazol-2-yl)piperidin-4-yl]ethanamine
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1-[(1-cyclopropylimidazol-2-yl)methyl]-4-methylsulfonyl-1,4-diazepane
CID 91843553

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-2-methylsulfonylimidazole?
The IUPAC name of 1-cyclohexyl-2-methylsulfonylimidazole (CID 82128342) is 1-cyclohexyl-2-methylsulfonylimidazole.
What is the SMILES notation for 1-cyclohexyl-2-methylsulfonylimidazole?
The canonical SMILES for 1-cyclohexyl-2-methylsulfonylimidazole is CS(=O)(=O)c1nccn1C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-2-methylsulfonylimidazole?
The InChIKey is QVMUUZSKACPPBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2S/c1-15(13,14)10-11-7-8-12(10)9-5-3-2-4-6-9/h7-9H,2-6H2,1H3.
What are the key properties of 1-cyclohexyl-2-methylsulfonylimidazole?
1-cyclohexyl-2-methylsulfonylimidazole has a molecular weight of 228.32 g/mol, XLogP of 1.79, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-2-methylsulfonylimidazole is sourced from PubChem (CID 82128342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).