3-cyclopropyl-1-(2,3-dihydrofuran-5-yl)cyclohexan-1-ol

C13H20O2 — CID 102650630

IUPAC3-cyclopropyl-1-(2,3-dihydrofuran-5-yl)cyclohexan-1-ol
SMILESOC1(C2=CCCO2)CCCC(C2CC2)C1
InChIInChI=1S/C13H20O2/c14-13(12-4-2-8-15-12)7-1-3-11(9-13)10-5-6-10/h4,10-11,14H,1-3,5-9H2
InChIKeyNNJLUKXIKYGARQ-UHFFFAOYSA-N
MW208.30 g/mol
LogP2.62
Rot. Bonds2

About 3-cyclopropyl-1-(2,3-dihydrofuran-5-yl)cyclohexan-1-ol

3-cyclopropyl-1-(2,3-dihydrofuran-5-yl)cyclohexan-1-ol (PubChem CID 102650630) has the molecular formula C13H20O2 and a molecular weight of 208.30 g/mol. Its IUPAC name is 3-cyclopropyl-1-(2,3-dihydrofuran-5-yl)cyclohexan-1-ol.

Molecular Properties

Compound Name3-cyclopropyl-1-(2,3-dihydrofuran-5-yl)cyclohexan-1-ol
PubChem CID102650630
Molecular FormulaC13H20O2
Molecular Weight208.30 g/mol
Exact Mass208.15
IUPAC Name3-cyclopropyl-1-(2,3-dihydrofuran-5-yl)cyclohexan-1-ol
SMILESOC1(C2=CCCO2)CCCC(C2CC2)C1
InChIInChI=1S/C13H20O2/c14-13(12-4-2-8-15-12)7-1-3-11(9-13)10-5-6-10/h4,10-11,14H,1-3,5-9H2
InChIKeyNNJLUKXIKYGARQ-UHFFFAOYSA-N
XLogP2.62
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-1-(2,3-dihydrofuran-5-yl)cyclohexan-1-ol?
The IUPAC name of 3-cyclopropyl-1-(2,3-dihydrofuran-5-yl)cyclohexan-1-ol (CID 102650630) is 3-cyclopropyl-1-(2,3-dihydrofuran-5-yl)cyclohexan-1-ol.
What is the SMILES notation for 3-cyclopropyl-1-(2,3-dihydrofuran-5-yl)cyclohexan-1-ol?
The canonical SMILES for 3-cyclopropyl-1-(2,3-dihydrofuran-5-yl)cyclohexan-1-ol is OC1(C2=CCCO2)CCCC(C2CC2)C1.
What is the InChIKey of 3-cyclopropyl-1-(2,3-dihydrofuran-5-yl)cyclohexan-1-ol?
The InChIKey is NNJLUKXIKYGARQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20O2/c14-13(12-4-2-8-15-12)7-1-3-11(9-13)10-5-6-10/h4,10-11,14H,1-3,5-9H2.
What are the key properties of 3-cyclopropyl-1-(2,3-dihydrofuran-5-yl)cyclohexan-1-ol?
3-cyclopropyl-1-(2,3-dihydrofuran-5-yl)cyclohexan-1-ol has a molecular weight of 208.30 g/mol, XLogP of 2.62, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-1-(2,3-dihydrofuran-5-yl)cyclohexan-1-ol is sourced from PubChem (CID 102650630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).