2,3,5-trimethyl-4-propan-2-ylcyclohexan-1-ol

C12H24O — CID 58534517

IUPAC2,3,5-trimethyl-4-propan-2-ylcyclohexan-1-ol
SMILESCC(C)C1C(C)CC(O)C(C)C1C
InChIInChI=1S/C12H24O/c1-7(2)12-8(3)6-11(13)9(4)10(12)5/h7-13H,6H2,1-5H3
InChIKeyLKDQMMOONCJYLQ-UHFFFAOYSA-N
MW184.32 g/mol
LogP2.93
Rot. Bonds1

About 2,3,5-trimethyl-4-propan-2-ylcyclohexan-1-ol

2,3,5-trimethyl-4-propan-2-ylcyclohexan-1-ol (PubChem CID 58534517) has the molecular formula C12H24O and a molecular weight of 184.32 g/mol. Its IUPAC name is 2,3,5-trimethyl-4-propan-2-ylcyclohexan-1-ol.

Molecular Properties

Compound Name2,3,5-trimethyl-4-propan-2-ylcyclohexan-1-ol
PubChem CID58534517
Molecular FormulaC12H24O
Molecular Weight184.32 g/mol
Exact Mass184.18
IUPAC Name2,3,5-trimethyl-4-propan-2-ylcyclohexan-1-ol
SMILESCC(C)C1C(C)CC(O)C(C)C1C
InChIInChI=1S/C12H24O/c1-7(2)12-8(3)6-11(13)9(4)10(12)5/h7-13H,6H2,1-5H3
InChIKeyLKDQMMOONCJYLQ-UHFFFAOYSA-N
XLogP2.93
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.32
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2,3,5-trimethyl-4-propan-2-ylcyclohexan-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

Related Compounds

4,5-dimethylcyclohexane-1,2-diol
CID 13429582
trans-(1R,3R)-2-methyl-5-propan-2-ylcyclohexane-1,3-diol
CID 6431599
1-cyclopropyl-2,4-dimethyl-3-propan-2-ylcyclopentane
CID 123954813
(1S)-2-methyl-5-propan-2-ylcyclohexane-1,4-diol
CID 91437445
cis-(2R,5R)-2-methyl-5-propan-2-ylcyclohexane-1,4-diol
CID 157009951
trans-(1S,2S)-2-methylcyclopropan-1-ol
CID 13410812
3-methyl-2,5,7-tri(propan-2-yl)cycloheptan-1-ol
CID 90951781
2-(1-hydroxyethyl)-4,5-dimethylcyclohexan-1-ol
CID 23443116
4-propan-2-ylcyclopentane-1,2-diol
CID 20608687
trans-(1R,2R)-cyclopropane-1,2-diol
CID 59075452
cis-(1S,5R)-2-methyl-5-propan-2-ylcyclohexan-1-ol
CID 168820123
5-tert-butyl-2,3-dimethylcyclohexan-1-ol
CID 58534407

Frequently Asked Questions

What is the IUPAC name of 2,3,5-trimethyl-4-propan-2-ylcyclohexan-1-ol?
The IUPAC name of 2,3,5-trimethyl-4-propan-2-ylcyclohexan-1-ol (CID 58534517) is 2,3,5-trimethyl-4-propan-2-ylcyclohexan-1-ol.
What is the SMILES notation for 2,3,5-trimethyl-4-propan-2-ylcyclohexan-1-ol?
The canonical SMILES for 2,3,5-trimethyl-4-propan-2-ylcyclohexan-1-ol is CC(C)C1C(C)CC(O)C(C)C1C.
What is the InChIKey of 2,3,5-trimethyl-4-propan-2-ylcyclohexan-1-ol?
The InChIKey is LKDQMMOONCJYLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24O/c1-7(2)12-8(3)6-11(13)9(4)10(12)5/h7-13H,6H2,1-5H3.
What are the key properties of 2,3,5-trimethyl-4-propan-2-ylcyclohexan-1-ol?
2,3,5-trimethyl-4-propan-2-ylcyclohexan-1-ol has a molecular weight of 184.32 g/mol, XLogP of 2.93, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,5-trimethyl-4-propan-2-ylcyclohexan-1-ol is sourced from PubChem (CID 58534517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).