1,1,2,3,3,6-hexamethyl-4,5,6,7-tetrahydro-2H-inden-5-ol

C15H26O — CID 19810364

IUPAC1,1,2,3,3,6-hexamethyl-4,5,6,7-tetrahydro-2H-inden-5-ol
SMILESCC1CC2=C(CC1O)C(C)(C)C(C)C2(C)C
InChIInChI=1S/C15H26O/c1-9-7-11-12(8-13(9)16)15(5,6)10(2)14(11,3)4/h9-10,13,16H,7-8H2,1-6H3
InChIKeyVVAODHNZUFXDJH-UHFFFAOYSA-N
MW222.37 g/mol
LogP3.78
Rot. Bonds

About 1,1,2,3,3,6-hexamethyl-4,5,6,7-tetrahydro-2H-inden-5-ol

1,1,2,3,3,6-hexamethyl-4,5,6,7-tetrahydro-2H-inden-5-ol (PubChem CID 19810364) has the molecular formula C15H26O and a molecular weight of 222.37 g/mol. Its IUPAC name is 1,1,2,3,3,6-hexamethyl-4,5,6,7-tetrahydro-2H-inden-5-ol.

Molecular Properties

Compound Name1,1,2,3,3,6-hexamethyl-4,5,6,7-tetrahydro-2H-inden-5-ol
PubChem CID19810364
Molecular FormulaC15H26O
Molecular Weight222.37 g/mol
Exact Mass222.20
IUPAC Name1,1,2,3,3,6-hexamethyl-4,5,6,7-tetrahydro-2H-inden-5-ol
SMILESCC1CC2=C(CC1O)C(C)(C)C(C)C2(C)C
InChIInChI=1S/C15H26O/c1-9-7-11-12(8-13(9)16)15(5,6)10(2)14(11,3)4/h9-10,13,16H,7-8H2,1-6H3
InChIKeyVVAODHNZUFXDJH-UHFFFAOYSA-N
XLogP3.78
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.37
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 1,1,2,3,3,6-hexamethyl-4,5,6,7-tetrahydro-2H-inden-5-ol with MolForge

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

Launch Full Analysis

Related Compounds

(4S,5R)-5-hydroxy-4,6,6-trimethyloxan-2-one
CID 13412067
1,1,2,3,3-pentamethyl-2,5,6,7-tetrahydroindene-4,4-diol
CID 91591502
(3E)-3-benzylidene-2,2-dimethylcyclobutan-1-ol
CID 46919084
trans-(1S,2S)-2-methylcyclopropan-1-ol
CID 13410812
5,7,7,8,9,9-hexamethyl-6,8-dihydro-5H-cyclopenta[h]quinazoline
CID 70926467
1,2,3,3,4,5-hexamethylcyclohexene;hydroiodide
CID 158511042
2,5,5,6,7,8,8-heptamethyl-1,2,6,7-tetrahydronaphthalene
CID 141114864
3,7-dimethyl-1,2,3,4-tetrahydronaphthalen-2-ol
CID 163891740
cis-(1S,5R)-2,2,5-trimethylcyclopentan-1-ol
CID 101036298
2,2,4-trimethylcyclopentane-1,3-diol
CID 142602394
4,7,7-trimethylbicyclo[4.1.1]octan-3-ol
CID 90911661
(3E)-2,2-dimethyl-3-[(4-phenylphenyl)methylidene]cyclobutan-1-ol
CID 46919184

Frequently Asked Questions

What is the IUPAC name of 1,1,2,3,3,6-hexamethyl-4,5,6,7-tetrahydro-2H-inden-5-ol?
The IUPAC name of 1,1,2,3,3,6-hexamethyl-4,5,6,7-tetrahydro-2H-inden-5-ol (CID 19810364) is 1,1,2,3,3,6-hexamethyl-4,5,6,7-tetrahydro-2H-inden-5-ol.
What is the SMILES notation for 1,1,2,3,3,6-hexamethyl-4,5,6,7-tetrahydro-2H-inden-5-ol?
The canonical SMILES for 1,1,2,3,3,6-hexamethyl-4,5,6,7-tetrahydro-2H-inden-5-ol is CC1CC2=C(CC1O)C(C)(C)C(C)C2(C)C.
What is the InChIKey of 1,1,2,3,3,6-hexamethyl-4,5,6,7-tetrahydro-2H-inden-5-ol?
The InChIKey is VVAODHNZUFXDJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26O/c1-9-7-11-12(8-13(9)16)15(5,6)10(2)14(11,3)4/h9-10,13,16H,7-8H2,1-6H3.
What are the key properties of 1,1,2,3,3,6-hexamethyl-4,5,6,7-tetrahydro-2H-inden-5-ol?
1,1,2,3,3,6-hexamethyl-4,5,6,7-tetrahydro-2H-inden-5-ol has a molecular weight of 222.37 g/mol, XLogP of 3.78, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,3,3,6-hexamethyl-4,5,6,7-tetrahydro-2H-inden-5-ol is sourced from PubChem (CID 19810364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).