[2-cyclopentyl-1-(5-methylsulfonylthiophen-3-yl)cyclopropyl]methanol

C14H20O3S2 — CID 67484329

IUPAC[2-cyclopentyl-1-(5-methylsulfonylthiophen-3-yl)cyclopropyl]methanol
SMILESCS(=O)(=O)c1cc(C2(CO)CC2C2CCCC2)cs1
InChIInChI=1S/C14H20O3S2/c1-19(16,17)13-6-11(8-18-13)14(9-15)7-12(14)10-4-2-3-5-10/h6,8,10,12,15H,2-5,7,9H2,1H3
InChIKeyYTYFZXJRNYMHDW-UHFFFAOYSA-N
MW300.44 g/mol
LogP2.59
Rot. Bonds4

About [2-cyclopentyl-1-(5-methylsulfonylthiophen-3-yl)cyclopropyl]methanol

[2-cyclopentyl-1-(5-methylsulfonylthiophen-3-yl)cyclopropyl]methanol (PubChem CID 67484329) has the molecular formula C14H20O3S2 and a molecular weight of 300.44 g/mol. Its IUPAC name is [2-cyclopentyl-1-(5-methylsulfonylthiophen-3-yl)cyclopropyl]methanol.

Molecular Properties

Compound Name[2-cyclopentyl-1-(5-methylsulfonylthiophen-3-yl)cyclopropyl]methanol
PubChem CID67484329
Molecular FormulaC14H20O3S2
Molecular Weight300.44 g/mol
Exact Mass300.09
IUPAC Name[2-cyclopentyl-1-(5-methylsulfonylthiophen-3-yl)cyclopropyl]methanol
SMILESCS(=O)(=O)c1cc(C2(CO)CC2C2CCCC2)cs1
InChIInChI=1S/C14H20O3S2/c1-19(16,17)13-6-11(8-18-13)14(9-15)7-12(14)10-4-2-3-5-10/h6,8,10,12,15H,2-5,7,9H2,1H3
InChIKeyYTYFZXJRNYMHDW-UHFFFAOYSA-N
XLogP2.59
TPSA54.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.44
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [2-cyclopentyl-1-(5-methylsulfonylthiophen-3-yl)cyclopropyl]methanol?
The IUPAC name of [2-cyclopentyl-1-(5-methylsulfonylthiophen-3-yl)cyclopropyl]methanol (CID 67484329) is [2-cyclopentyl-1-(5-methylsulfonylthiophen-3-yl)cyclopropyl]methanol.
What is the SMILES notation for [2-cyclopentyl-1-(5-methylsulfonylthiophen-3-yl)cyclopropyl]methanol?
The canonical SMILES for [2-cyclopentyl-1-(5-methylsulfonylthiophen-3-yl)cyclopropyl]methanol is CS(=O)(=O)c1cc(C2(CO)CC2C2CCCC2)cs1.
What is the InChIKey of [2-cyclopentyl-1-(5-methylsulfonylthiophen-3-yl)cyclopropyl]methanol?
The InChIKey is YTYFZXJRNYMHDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20O3S2/c1-19(16,17)13-6-11(8-18-13)14(9-15)7-12(14)10-4-2-3-5-10/h6,8,10,12,15H,2-5,7,9H2,1H3.
What are the key properties of [2-cyclopentyl-1-(5-methylsulfonylthiophen-3-yl)cyclopropyl]methanol?
[2-cyclopentyl-1-(5-methylsulfonylthiophen-3-yl)cyclopropyl]methanol has a molecular weight of 300.44 g/mol, XLogP of 2.59, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-cyclopentyl-1-(5-methylsulfonylthiophen-3-yl)cyclopropyl]methanol is sourced from PubChem (CID 67484329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).