2-cyclohexyl-1-cyclopentyl-2-ethoxyethanol

C15H28O2 — CID 116756693

IUPAC2-cyclohexyl-1-cyclopentyl-2-ethoxyethanol
SMILESCCOC(C1CCCCC1)C(O)C1CCCC1
InChIInChI=1S/C15H28O2/c1-2-17-15(13-10-4-3-5-11-13)14(16)12-8-6-7-9-12/h12-16H,2-11H2,1H3
InChIKeyCHGLGHATPIUZRO-UHFFFAOYSA-N
MW240.39 g/mol
LogP3.52
Rot. Bonds5

About 2-cyclohexyl-1-cyclopentyl-2-ethoxyethanol

2-cyclohexyl-1-cyclopentyl-2-ethoxyethanol (PubChem CID 116756693) has the molecular formula C15H28O2 and a molecular weight of 240.39 g/mol. Its IUPAC name is 2-cyclohexyl-1-cyclopentyl-2-ethoxyethanol.

Molecular Properties

Compound Name2-cyclohexyl-1-cyclopentyl-2-ethoxyethanol
PubChem CID116756693
Molecular FormulaC15H28O2
Molecular Weight240.39 g/mol
Exact Mass240.21
IUPAC Name2-cyclohexyl-1-cyclopentyl-2-ethoxyethanol
SMILESCCOC(C1CCCCC1)C(O)C1CCCC1
InChIInChI=1S/C15H28O2/c1-2-17-15(13-10-4-3-5-11-13)14(16)12-8-6-7-9-12/h12-16H,2-11H2,1H3
InChIKeyCHGLGHATPIUZRO-UHFFFAOYSA-N
XLogP3.52
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 ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-1-cyclopentyl-2-ethoxyethanol?
The IUPAC name of 2-cyclohexyl-1-cyclopentyl-2-ethoxyethanol (CID 116756693) is 2-cyclohexyl-1-cyclopentyl-2-ethoxyethanol.
What is the SMILES notation for 2-cyclohexyl-1-cyclopentyl-2-ethoxyethanol?
The canonical SMILES for 2-cyclohexyl-1-cyclopentyl-2-ethoxyethanol is CCOC(C1CCCCC1)C(O)C1CCCC1.
What is the InChIKey of 2-cyclohexyl-1-cyclopentyl-2-ethoxyethanol?
The InChIKey is CHGLGHATPIUZRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28O2/c1-2-17-15(13-10-4-3-5-11-13)14(16)12-8-6-7-9-12/h12-16H,2-11H2,1H3.
What are the key properties of 2-cyclohexyl-1-cyclopentyl-2-ethoxyethanol?
2-cyclohexyl-1-cyclopentyl-2-ethoxyethanol has a molecular weight of 240.39 g/mol, XLogP of 3.52, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-1-cyclopentyl-2-ethoxyethanol is sourced from PubChem (CID 116756693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).