(2-cyclopropyl-2-thiophen-2-ylcyclopropyl)methanol

C11H14OS — CID 81358092

IUPAC(2-cyclopropyl-2-thiophen-2-ylcyclopropyl)methanol
SMILESOCC1CC1(c1cccs1)C1CC1
InChIInChI=1S/C11H14OS/c12-7-9-6-11(9,8-3-4-8)10-2-1-5-13-10/h1-2,5,8-9,12H,3-4,6-7H2
InChIKeyJUAKPRLQKCXQAQ-UHFFFAOYSA-N
MW194.30 g/mol
LogP2.41
Rot. Bonds3

About (2-cyclopropyl-2-thiophen-2-ylcyclopropyl)methanol

(2-cyclopropyl-2-thiophen-2-ylcyclopropyl)methanol (PubChem CID 81358092) has the molecular formula C11H14OS and a molecular weight of 194.30 g/mol. Its IUPAC name is (2-cyclopropyl-2-thiophen-2-ylcyclopropyl)methanol.

Molecular Properties

Compound Name(2-cyclopropyl-2-thiophen-2-ylcyclopropyl)methanol
PubChem CID81358092
Molecular FormulaC11H14OS
Molecular Weight194.30 g/mol
Exact Mass194.08
IUPAC Name(2-cyclopropyl-2-thiophen-2-ylcyclopropyl)methanol
SMILESOCC1CC1(c1cccs1)C1CC1
InChIInChI=1S/C11H14OS/c12-7-9-6-11(9,8-3-4-8)10-2-1-5-13-10/h1-2,5,8-9,12H,3-4,6-7H2
InChIKeyJUAKPRLQKCXQAQ-UHFFFAOYSA-N
XLogP2.41
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.30
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2-cyclopropyl-2-thiophen-2-ylcyclopropyl)methanol?
The IUPAC name of (2-cyclopropyl-2-thiophen-2-ylcyclopropyl)methanol (CID 81358092) is (2-cyclopropyl-2-thiophen-2-ylcyclopropyl)methanol.
What is the SMILES notation for (2-cyclopropyl-2-thiophen-2-ylcyclopropyl)methanol?
The canonical SMILES for (2-cyclopropyl-2-thiophen-2-ylcyclopropyl)methanol is OCC1CC1(c1cccs1)C1CC1.
What is the InChIKey of (2-cyclopropyl-2-thiophen-2-ylcyclopropyl)methanol?
The InChIKey is JUAKPRLQKCXQAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14OS/c12-7-9-6-11(9,8-3-4-8)10-2-1-5-13-10/h1-2,5,8-9,12H,3-4,6-7H2.
What are the key properties of (2-cyclopropyl-2-thiophen-2-ylcyclopropyl)methanol?
(2-cyclopropyl-2-thiophen-2-ylcyclopropyl)methanol has a molecular weight of 194.30 g/mol, XLogP of 2.41, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-cyclopropyl-2-thiophen-2-ylcyclopropyl)methanol is sourced from PubChem (CID 81358092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).