2-(2-cyclobutylethoxy)-4-propan-2-ylcyclohexan-1-ol

C15H28O2 — CID 114157781

IUPAC2-(2-cyclobutylethoxy)-4-propan-2-ylcyclohexan-1-ol
SMILESCC(C)C1CCC(O)C(OCCC2CCC2)C1
InChIInChI=1S/C15H28O2/c1-11(2)13-6-7-14(16)15(10-13)17-9-8-12-4-3-5-12/h11-16H,3-10H2,1-2H3
InChIKeyOYVKEKVSKVDVTM-UHFFFAOYSA-N
MW240.39 g/mol
LogP3.38
Rot. Bonds5

About 2-(2-cyclobutylethoxy)-4-propan-2-ylcyclohexan-1-ol

2-(2-cyclobutylethoxy)-4-propan-2-ylcyclohexan-1-ol (PubChem CID 114157781) has the molecular formula C15H28O2 and a molecular weight of 240.39 g/mol. Its IUPAC name is 2-(2-cyclobutylethoxy)-4-propan-2-ylcyclohexan-1-ol.

Molecular Properties

Compound Name2-(2-cyclobutylethoxy)-4-propan-2-ylcyclohexan-1-ol
PubChem CID114157781
Molecular FormulaC15H28O2
Molecular Weight240.39 g/mol
Exact Mass240.21
IUPAC Name2-(2-cyclobutylethoxy)-4-propan-2-ylcyclohexan-1-ol
SMILESCC(C)C1CCC(O)C(OCCC2CCC2)C1
InChIInChI=1S/C15H28O2/c1-11(2)13-6-7-14(16)15(10-13)17-9-8-12-4-3-5-12/h11-16H,3-10H2,1-2H3
InChIKeyOYVKEKVSKVDVTM-UHFFFAOYSA-N
XLogP3.38
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclobutylethoxy)-4-propan-2-ylcyclohexan-1-ol?
The IUPAC name of 2-(2-cyclobutylethoxy)-4-propan-2-ylcyclohexan-1-ol (CID 114157781) is 2-(2-cyclobutylethoxy)-4-propan-2-ylcyclohexan-1-ol.
What is the SMILES notation for 2-(2-cyclobutylethoxy)-4-propan-2-ylcyclohexan-1-ol?
The canonical SMILES for 2-(2-cyclobutylethoxy)-4-propan-2-ylcyclohexan-1-ol is CC(C)C1CCC(O)C(OCCC2CCC2)C1.
What is the InChIKey of 2-(2-cyclobutylethoxy)-4-propan-2-ylcyclohexan-1-ol?
The InChIKey is OYVKEKVSKVDVTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28O2/c1-11(2)13-6-7-14(16)15(10-13)17-9-8-12-4-3-5-12/h11-16H,3-10H2,1-2H3.
What are the key properties of 2-(2-cyclobutylethoxy)-4-propan-2-ylcyclohexan-1-ol?
2-(2-cyclobutylethoxy)-4-propan-2-ylcyclohexan-1-ol has a molecular weight of 240.39 g/mol, XLogP of 3.38, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclobutylethoxy)-4-propan-2-ylcyclohexan-1-ol is sourced from PubChem (CID 114157781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).