2-cyclopropyl-9,9-dimethyldecan-2-ol

C15H30O — CID 123608266

IUPAC2-cyclopropyl-9,9-dimethyldecan-2-ol
SMILESCC(C)(C)CCCCCCC(C)(O)C1CC1
InChIInChI=1S/C15H30O/c1-14(2,3)11-7-5-6-8-12-15(4,16)13-9-10-13/h13,16H,5-12H2,1-4H3
InChIKeyKYSVTGMTRLBCKX-UHFFFAOYSA-N
MW226.40 g/mol
LogP4.53
Rot. Bonds7

About 2-cyclopropyl-9,9-dimethyldecan-2-ol

2-cyclopropyl-9,9-dimethyldecan-2-ol (PubChem CID 123608266) has the molecular formula C15H30O and a molecular weight of 226.40 g/mol. Its IUPAC name is 2-cyclopropyl-9,9-dimethyldecan-2-ol.

Molecular Properties

Compound Name2-cyclopropyl-9,9-dimethyldecan-2-ol
PubChem CID123608266
Molecular FormulaC15H30O
Molecular Weight226.40 g/mol
Exact Mass226.23
IUPAC Name2-cyclopropyl-9,9-dimethyldecan-2-ol
SMILESCC(C)(C)CCCCCCC(C)(O)C1CC1
InChIInChI=1S/C15H30O/c1-14(2,3)11-7-5-6-8-12-15(4,16)13-9-10-13/h13,16H,5-12H2,1-4H3
InChIKeyKYSVTGMTRLBCKX-UHFFFAOYSA-N
XLogP4.53
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.40
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-Cyclohexylcyclopropan-1-ol
CID 15047052
Cyclohexanemethanol, alpha,alpha-dimethyl-
CID 85531
2-Cyclohexyl-hexan-2-ol
CID 568244
2-(4,4-Dimethylcyclohexyl)propan-2-ol
CID 2825220
1-Tert-butylcyclohexan-1-ol
CID 287917
2,3-Dimethyloctan-3-ol
CID 140598
Trimethylnonanol
CID 18458409
2,2,4-Trimethylnonan-4-ol
CID 219523
5-Tert-butylnonan-5-ol
CID 219531
2-Cyclooctyl-2-propanol
CID 27966
3-Cyclohexyl-2-methylbutan-2-ol
CID 20443431
4-Cyclohexyl-2-methylpentan-2-ol
CID 67400066

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-9,9-dimethyldecan-2-ol?
The IUPAC name of 2-cyclopropyl-9,9-dimethyldecan-2-ol (CID 123608266) is 2-cyclopropyl-9,9-dimethyldecan-2-ol.
What is the SMILES notation for 2-cyclopropyl-9,9-dimethyldecan-2-ol?
The canonical SMILES for 2-cyclopropyl-9,9-dimethyldecan-2-ol is CC(C)(C)CCCCCCC(C)(O)C1CC1.
What is the InChIKey of 2-cyclopropyl-9,9-dimethyldecan-2-ol?
The InChIKey is KYSVTGMTRLBCKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30O/c1-14(2,3)11-7-5-6-8-12-15(4,16)13-9-10-13/h13,16H,5-12H2,1-4H3.
What are the key properties of 2-cyclopropyl-9,9-dimethyldecan-2-ol?
2-cyclopropyl-9,9-dimethyldecan-2-ol has a molecular weight of 226.40 g/mol, XLogP of 4.53, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-9,9-dimethyldecan-2-ol is sourced from PubChem (CID 123608266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).