4-(2-methylprop-2-enyl)cyclohexan-1-ol

C10H18O — CID 57052055

IUPAC4-(2-methylprop-2-enyl)cyclohexan-1-ol
SMILESC=C(C)CC1CCC(O)CC1
InChIInChI=1S/C10H18O/c1-8(2)7-9-3-5-10(11)6-4-9/h9-11H,1,3-7H2,2H3
InChIKeyGXDHFRDQLLOBKL-UHFFFAOYSA-N
MW154.25 g/mol
LogP2.50
Rot. Bonds2

About 4-(2-methylprop-2-enyl)cyclohexan-1-ol

4-(2-methylprop-2-enyl)cyclohexan-1-ol (PubChem CID 57052055) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is 4-(2-methylprop-2-enyl)cyclohexan-1-ol.

Molecular Properties

Compound Name4-(2-methylprop-2-enyl)cyclohexan-1-ol
PubChem CID57052055
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name4-(2-methylprop-2-enyl)cyclohexan-1-ol
SMILESC=C(C)CC1CCC(O)CC1
InChIInChI=1S/C10H18O/c1-8(2)7-9-3-5-10(11)6-4-9/h9-11H,1,3-7H2,2H3
InChIKeyGXDHFRDQLLOBKL-UHFFFAOYSA-N
XLogP2.50
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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-enyl)cyclohexan-1-ol?
The IUPAC name of 4-(2-methylprop-2-enyl)cyclohexan-1-ol (CID 57052055) is 4-(2-methylprop-2-enyl)cyclohexan-1-ol.
What is the SMILES notation for 4-(2-methylprop-2-enyl)cyclohexan-1-ol?
The canonical SMILES for 4-(2-methylprop-2-enyl)cyclohexan-1-ol is C=C(C)CC1CCC(O)CC1.
What is the InChIKey of 4-(2-methylprop-2-enyl)cyclohexan-1-ol?
The InChIKey is GXDHFRDQLLOBKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O/c1-8(2)7-9-3-5-10(11)6-4-9/h9-11H,1,3-7H2,2H3.
What are the key properties of 4-(2-methylprop-2-enyl)cyclohexan-1-ol?
4-(2-methylprop-2-enyl)cyclohexan-1-ol has a molecular weight of 154.25 g/mol, XLogP of 2.50, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylprop-2-enyl)cyclohexan-1-ol is sourced from PubChem (CID 57052055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).