2-[(3R)-2-methyl-5-(2-methylcyclohexyl)oxolan-3-yl]ethanol

C14H26O2 — CID 70985802

IUPAC2-[(3R)-2-methyl-5-(2-methylcyclohexyl)oxolan-3-yl]ethanol
SMILESCC1CCCCC1C1C[C@@H](CCO)C(C)O1
InChIInChI=1S/C14H26O2/c1-10-5-3-4-6-13(10)14-9-12(7-8-15)11(2)16-14/h10-15H,3-9H2,1-2H3/t10?,11?,12-,13?,14?/m1/s1
InChIKeyWPZSVSQTCUFPIU-XHLRWWMNSA-N
MW226.36 g/mol
LogP2.99
Rot. Bonds3

About 2-[(3R)-2-methyl-5-(2-methylcyclohexyl)oxolan-3-yl]ethanol

2-[(3R)-2-methyl-5-(2-methylcyclohexyl)oxolan-3-yl]ethanol (PubChem CID 70985802) has the molecular formula C14H26O2 and a molecular weight of 226.36 g/mol. Its IUPAC name is 2-[(3R)-2-methyl-5-(2-methylcyclohexyl)oxolan-3-yl]ethanol.

Molecular Properties

Compound Name2-[(3R)-2-methyl-5-(2-methylcyclohexyl)oxolan-3-yl]ethanol
PubChem CID70985802
Molecular FormulaC14H26O2
Molecular Weight226.36 g/mol
Exact Mass226.19
IUPAC Name2-[(3R)-2-methyl-5-(2-methylcyclohexyl)oxolan-3-yl]ethanol
SMILESCC1CCCCC1C1C[C@@H](CCO)C(C)O1
InChIInChI=1S/C14H26O2/c1-10-5-3-4-6-13(10)14-9-12(7-8-15)11(2)16-14/h10-15H,3-9H2,1-2H3/t10?,11?,12-,13?,14?/m1/s1
InChIKeyWPZSVSQTCUFPIU-XHLRWWMNSA-N
XLogP2.99
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(3R)-2-methyl-5-(2-methylcyclohexyl)oxolan-3-yl]ethanol?
The IUPAC name of 2-[(3R)-2-methyl-5-(2-methylcyclohexyl)oxolan-3-yl]ethanol (CID 70985802) is 2-[(3R)-2-methyl-5-(2-methylcyclohexyl)oxolan-3-yl]ethanol.
What is the SMILES notation for 2-[(3R)-2-methyl-5-(2-methylcyclohexyl)oxolan-3-yl]ethanol?
The canonical SMILES for 2-[(3R)-2-methyl-5-(2-methylcyclohexyl)oxolan-3-yl]ethanol is CC1CCCCC1C1C[C@@H](CCO)C(C)O1.
What is the InChIKey of 2-[(3R)-2-methyl-5-(2-methylcyclohexyl)oxolan-3-yl]ethanol?
The InChIKey is WPZSVSQTCUFPIU-XHLRWWMNSA-N. The full InChI is InChI=1S/C14H26O2/c1-10-5-3-4-6-13(10)14-9-12(7-8-15)11(2)16-14/h10-15H,3-9H2,1-2H3/t10?,11?,12-,13?,14?/m1/s1.
What are the key properties of 2-[(3R)-2-methyl-5-(2-methylcyclohexyl)oxolan-3-yl]ethanol?
2-[(3R)-2-methyl-5-(2-methylcyclohexyl)oxolan-3-yl]ethanol has a molecular weight of 226.36 g/mol, XLogP of 2.99, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3R)-2-methyl-5-(2-methylcyclohexyl)oxolan-3-yl]ethanol is sourced from PubChem (CID 70985802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).