1-(6-bicyclo[3.1.0]hexanyl)-3-cyclopropylpropan-1-ol

C12H20O — CID 115810718

IUPAC1-(6-bicyclo[3.1.0]hexanyl)-3-cyclopropylpropan-1-ol
SMILESOC(CCC1CC1)C1C2CCCC21
InChIInChI=1S/C12H20O/c13-11(7-6-8-4-5-8)12-9-2-1-3-10(9)12/h8-13H,1-7H2
InChIKeyBVAJAOLUELITEV-UHFFFAOYSA-N
MW180.29 g/mol
LogP2.58
Rot. Bonds4

About 1-(6-bicyclo[3.1.0]hexanyl)-3-cyclopropylpropan-1-ol

1-(6-bicyclo[3.1.0]hexanyl)-3-cyclopropylpropan-1-ol (PubChem CID 115810718) has the molecular formula C12H20O and a molecular weight of 180.29 g/mol. Its IUPAC name is 1-(6-bicyclo[3.1.0]hexanyl)-3-cyclopropylpropan-1-ol.

Molecular Properties

Compound Name1-(6-bicyclo[3.1.0]hexanyl)-3-cyclopropylpropan-1-ol
PubChem CID115810718
Molecular FormulaC12H20O
Molecular Weight180.29 g/mol
Exact Mass180.15
IUPAC Name1-(6-bicyclo[3.1.0]hexanyl)-3-cyclopropylpropan-1-ol
SMILESOC(CCC1CC1)C1C2CCCC21
InChIInChI=1S/C12H20O/c13-11(7-6-8-4-5-8)12-9-2-1-3-10(9)12/h8-13H,1-7H2
InChIKeyBVAJAOLUELITEV-UHFFFAOYSA-N
XLogP2.58
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.29
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(6-bicyclo[3.1.0]hexanyl)-3-cyclopropylpropan-1-ol?
The IUPAC name of 1-(6-bicyclo[3.1.0]hexanyl)-3-cyclopropylpropan-1-ol (CID 115810718) is 1-(6-bicyclo[3.1.0]hexanyl)-3-cyclopropylpropan-1-ol.
What is the SMILES notation for 1-(6-bicyclo[3.1.0]hexanyl)-3-cyclopropylpropan-1-ol?
The canonical SMILES for 1-(6-bicyclo[3.1.0]hexanyl)-3-cyclopropylpropan-1-ol is OC(CCC1CC1)C1C2CCCC21.
What is the InChIKey of 1-(6-bicyclo[3.1.0]hexanyl)-3-cyclopropylpropan-1-ol?
The InChIKey is BVAJAOLUELITEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20O/c13-11(7-6-8-4-5-8)12-9-2-1-3-10(9)12/h8-13H,1-7H2.
What are the key properties of 1-(6-bicyclo[3.1.0]hexanyl)-3-cyclopropylpropan-1-ol?
1-(6-bicyclo[3.1.0]hexanyl)-3-cyclopropylpropan-1-ol has a molecular weight of 180.29 g/mol, XLogP of 2.58, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-bicyclo[3.1.0]hexanyl)-3-cyclopropylpropan-1-ol is sourced from PubChem (CID 115810718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).