(1-cyclohexylsulfonylcyclopropyl)methanol

C10H18O3S — CID 117037467

IUPAC(1-cyclohexylsulfonylcyclopropyl)methanol
SMILESO=S(=O)(C1CCCCC1)C1(CO)CC1
InChIInChI=1S/C10H18O3S/c11-8-10(6-7-10)14(12,13)9-4-2-1-3-5-9/h9,11H,1-8H2
InChIKeyLFJYMMFEUJPIGM-UHFFFAOYSA-N
MW218.32 g/mol
LogP1.26
Rot. Bonds3

About (1-cyclohexylsulfonylcyclopropyl)methanol

(1-cyclohexylsulfonylcyclopropyl)methanol (PubChem CID 117037467) has the molecular formula C10H18O3S and a molecular weight of 218.32 g/mol. Its IUPAC name is (1-cyclohexylsulfonylcyclopropyl)methanol.

Molecular Properties

Compound Name(1-cyclohexylsulfonylcyclopropyl)methanol
PubChem CID117037467
Molecular FormulaC10H18O3S
Molecular Weight218.32 g/mol
Exact Mass218.10
IUPAC Name(1-cyclohexylsulfonylcyclopropyl)methanol
SMILESO=S(=O)(C1CCCCC1)C1(CO)CC1
InChIInChI=1S/C10H18O3S/c11-8-10(6-7-10)14(12,13)9-4-2-1-3-5-9/h9,11H,1-8H2
InChIKeyLFJYMMFEUJPIGM-UHFFFAOYSA-N
XLogP1.26
TPSA54.37 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.32
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (1-cyclohexylsulfonylcyclopropyl)methanol?
The IUPAC name of (1-cyclohexylsulfonylcyclopropyl)methanol (CID 117037467) is (1-cyclohexylsulfonylcyclopropyl)methanol.
What is the SMILES notation for (1-cyclohexylsulfonylcyclopropyl)methanol?
The canonical SMILES for (1-cyclohexylsulfonylcyclopropyl)methanol is O=S(=O)(C1CCCCC1)C1(CO)CC1.
What is the InChIKey of (1-cyclohexylsulfonylcyclopropyl)methanol?
The InChIKey is LFJYMMFEUJPIGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O3S/c11-8-10(6-7-10)14(12,13)9-4-2-1-3-5-9/h9,11H,1-8H2.
What are the key properties of (1-cyclohexylsulfonylcyclopropyl)methanol?
(1-cyclohexylsulfonylcyclopropyl)methanol has a molecular weight of 218.32 g/mol, XLogP of 1.26, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-cyclohexylsulfonylcyclopropyl)methanol is sourced from PubChem (CID 117037467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).