[4-(2-methylprop-2-enoxy)cyclohexyl]methanol

C11H20O2 — CID 106825394

IUPAC[4-(2-methylprop-2-enoxy)cyclohexyl]methanol
SMILESC=C(C)COC1CCC(CO)CC1
InChIInChI=1S/C11H20O2/c1-9(2)8-13-11-5-3-10(7-12)4-6-11/h10-12H,1,3-8H2,2H3
InChIKeyMUYDMQVPOHSQPE-UHFFFAOYSA-N
MW184.28 g/mol
LogP2.13
Rot. Bonds4

About [4-(2-methylprop-2-enoxy)cyclohexyl]methanol

[4-(2-methylprop-2-enoxy)cyclohexyl]methanol (PubChem CID 106825394) has the molecular formula C11H20O2 and a molecular weight of 184.28 g/mol. Its IUPAC name is [4-(2-methylprop-2-enoxy)cyclohexyl]methanol.

Molecular Properties

Compound Name[4-(2-methylprop-2-enoxy)cyclohexyl]methanol
PubChem CID106825394
Molecular FormulaC11H20O2
Molecular Weight184.28 g/mol
Exact Mass184.15
IUPAC Name[4-(2-methylprop-2-enoxy)cyclohexyl]methanol
SMILESC=C(C)COC1CCC(CO)CC1
InChIInChI=1S/C11H20O2/c1-9(2)8-13-11-5-3-10(7-12)4-6-11/h10-12H,1,3-8H2,2H3
InChIKeyMUYDMQVPOHSQPE-UHFFFAOYSA-N
XLogP2.13
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [4-(2-methylprop-2-enoxy)cyclohexyl]methanol?
The IUPAC name of [4-(2-methylprop-2-enoxy)cyclohexyl]methanol (CID 106825394) is [4-(2-methylprop-2-enoxy)cyclohexyl]methanol.
What is the SMILES notation for [4-(2-methylprop-2-enoxy)cyclohexyl]methanol?
The canonical SMILES for [4-(2-methylprop-2-enoxy)cyclohexyl]methanol is C=C(C)COC1CCC(CO)CC1.
What is the InChIKey of [4-(2-methylprop-2-enoxy)cyclohexyl]methanol?
The InChIKey is MUYDMQVPOHSQPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O2/c1-9(2)8-13-11-5-3-10(7-12)4-6-11/h10-12H,1,3-8H2,2H3.
What are the key properties of [4-(2-methylprop-2-enoxy)cyclohexyl]methanol?
[4-(2-methylprop-2-enoxy)cyclohexyl]methanol has a molecular weight of 184.28 g/mol, XLogP of 2.13, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-methylprop-2-enoxy)cyclohexyl]methanol is sourced from PubChem (CID 106825394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).