2-cyclopropyl-1-(2-methyloxan-2-yl)ethanol

C11H20O2 — CID 80684699

IUPAC2-cyclopropyl-1-(2-methyloxan-2-yl)ethanol
SMILESCC1(C(O)CC2CC2)CCCCO1
InChIInChI=1S/C11H20O2/c1-11(6-2-3-7-13-11)10(12)8-9-4-5-9/h9-10,12H,2-8H2,1H3
InChIKeyIIESANBKJRFJRA-UHFFFAOYSA-N
MW184.28 g/mol
LogP2.11
Rot. Bonds3

About 2-cyclopropyl-1-(2-methyloxan-2-yl)ethanol

2-cyclopropyl-1-(2-methyloxan-2-yl)ethanol (PubChem CID 80684699) has the molecular formula C11H20O2 and a molecular weight of 184.28 g/mol. Its IUPAC name is 2-cyclopropyl-1-(2-methyloxan-2-yl)ethanol.

Molecular Properties

Compound Name2-cyclopropyl-1-(2-methyloxan-2-yl)ethanol
PubChem CID80684699
Molecular FormulaC11H20O2
Molecular Weight184.28 g/mol
Exact Mass184.15
IUPAC Name2-cyclopropyl-1-(2-methyloxan-2-yl)ethanol
SMILESCC1(C(O)CC2CC2)CCCCO1
InChIInChI=1S/C11H20O2/c1-11(6-2-3-7-13-11)10(12)8-9-4-5-9/h9-10,12H,2-8H2,1H3
InChIKeyIIESANBKJRFJRA-UHFFFAOYSA-N
XLogP2.11
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-(2-methyloxan-2-yl)ethanol?
The IUPAC name of 2-cyclopropyl-1-(2-methyloxan-2-yl)ethanol (CID 80684699) is 2-cyclopropyl-1-(2-methyloxan-2-yl)ethanol.
What is the SMILES notation for 2-cyclopropyl-1-(2-methyloxan-2-yl)ethanol?
The canonical SMILES for 2-cyclopropyl-1-(2-methyloxan-2-yl)ethanol is CC1(C(O)CC2CC2)CCCCO1.
What is the InChIKey of 2-cyclopropyl-1-(2-methyloxan-2-yl)ethanol?
The InChIKey is IIESANBKJRFJRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O2/c1-11(6-2-3-7-13-11)10(12)8-9-4-5-9/h9-10,12H,2-8H2,1H3.
What are the key properties of 2-cyclopropyl-1-(2-methyloxan-2-yl)ethanol?
2-cyclopropyl-1-(2-methyloxan-2-yl)ethanol has a molecular weight of 184.28 g/mol, XLogP of 2.11, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-(2-methyloxan-2-yl)ethanol is sourced from PubChem (CID 80684699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).