1,2,4,6-tetramethyl-6-(3-methylbut-2-enyl)cyclohex-2-en-1-ol

C15H26O — CID 22026352

IUPAC1,2,4,6-tetramethyl-6-(3-methylbut-2-enyl)cyclohex-2-en-1-ol
SMILESCC(C)=CCC1(C)CC(C)C=C(C)C1(C)O
InChIInChI=1S/C15H26O/c1-11(2)7-8-14(5)10-12(3)9-13(4)15(14,6)16/h7,9,12,16H,8,10H2,1-6H3
InChIKeyYKYCBLWJZDOIMN-UHFFFAOYSA-N
MW222.37 g/mol
LogP4.09
Rot. Bonds2

About 1,2,4,6-tetramethyl-6-(3-methylbut-2-enyl)cyclohex-2-en-1-ol

1,2,4,6-tetramethyl-6-(3-methylbut-2-enyl)cyclohex-2-en-1-ol (PubChem CID 22026352) has the molecular formula C15H26O and a molecular weight of 222.37 g/mol. Its IUPAC name is 1,2,4,6-tetramethyl-6-(3-methylbut-2-enyl)cyclohex-2-en-1-ol.

Molecular Properties

Compound Name1,2,4,6-tetramethyl-6-(3-methylbut-2-enyl)cyclohex-2-en-1-ol
PubChem CID22026352
Molecular FormulaC15H26O
Molecular Weight222.37 g/mol
Exact Mass222.20
IUPAC Name1,2,4,6-tetramethyl-6-(3-methylbut-2-enyl)cyclohex-2-en-1-ol
SMILESCC(C)=CCC1(C)CC(C)C=C(C)C1(C)O
InChIInChI=1S/C15H26O/c1-11(2)7-8-14(5)10-12(3)9-13(4)15(14,6)16/h7,9,12,16H,8,10H2,1-6H3
InChIKeyYKYCBLWJZDOIMN-UHFFFAOYSA-N
XLogP4.09
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.37
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 1,2,4,6-tetramethyl-6-(3-methylbut-2-enyl)cyclohex-2-en-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1,2,4,6-tetramethyl-6-(3-methylbut-2-enyl)cyclohex-2-en-1-ol?
The IUPAC name of 1,2,4,6-tetramethyl-6-(3-methylbut-2-enyl)cyclohex-2-en-1-ol (CID 22026352) is 1,2,4,6-tetramethyl-6-(3-methylbut-2-enyl)cyclohex-2-en-1-ol.
What is the SMILES notation for 1,2,4,6-tetramethyl-6-(3-methylbut-2-enyl)cyclohex-2-en-1-ol?
The canonical SMILES for 1,2,4,6-tetramethyl-6-(3-methylbut-2-enyl)cyclohex-2-en-1-ol is CC(C)=CCC1(C)CC(C)C=C(C)C1(C)O.
What is the InChIKey of 1,2,4,6-tetramethyl-6-(3-methylbut-2-enyl)cyclohex-2-en-1-ol?
The InChIKey is YKYCBLWJZDOIMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26O/c1-11(2)7-8-14(5)10-12(3)9-13(4)15(14,6)16/h7,9,12,16H,8,10H2,1-6H3.
What are the key properties of 1,2,4,6-tetramethyl-6-(3-methylbut-2-enyl)cyclohex-2-en-1-ol?
1,2,4,6-tetramethyl-6-(3-methylbut-2-enyl)cyclohex-2-en-1-ol has a molecular weight of 222.37 g/mol, XLogP of 4.09, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,4,6-tetramethyl-6-(3-methylbut-2-enyl)cyclohex-2-en-1-ol is sourced from PubChem (CID 22026352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).