1-(2-cyclopropylethyl)-3,3,5-trimethylcyclohexan-1-ol

C14H26O — CID 106590352

IUPAC1-(2-cyclopropylethyl)-3,3,5-trimethylcyclohexan-1-ol
SMILESCC1CC(C)(C)CC(O)(CCC2CC2)C1
InChIInChI=1S/C14H26O/c1-11-8-13(2,3)10-14(15,9-11)7-6-12-4-5-12/h11-12,15H,4-10H2,1-3H3
InChIKeyWNGIJZRGHUDMDO-UHFFFAOYSA-N
MW210.36 g/mol
LogP3.75
Rot. Bonds3

About 1-(2-cyclopropylethyl)-3,3,5-trimethylcyclohexan-1-ol

1-(2-cyclopropylethyl)-3,3,5-trimethylcyclohexan-1-ol (PubChem CID 106590352) has the molecular formula C14H26O and a molecular weight of 210.36 g/mol. Its IUPAC name is 1-(2-cyclopropylethyl)-3,3,5-trimethylcyclohexan-1-ol.

Molecular Properties

Compound Name1-(2-cyclopropylethyl)-3,3,5-trimethylcyclohexan-1-ol
PubChem CID106590352
Molecular FormulaC14H26O
Molecular Weight210.36 g/mol
Exact Mass210.20
IUPAC Name1-(2-cyclopropylethyl)-3,3,5-trimethylcyclohexan-1-ol
SMILESCC1CC(C)(C)CC(O)(CCC2CC2)C1
InChIInChI=1S/C14H26O/c1-11-8-13(2,3)10-14(15,9-11)7-6-12-4-5-12/h11-12,15H,4-10H2,1-3H3
InChIKeyWNGIJZRGHUDMDO-UHFFFAOYSA-N
XLogP3.75
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(cyclopentylmethyl)-3,3,5-trimethylcyclohexan-1-ol
CID 65147728
(1R)-1-ethyl-3,3,5-trimethylcyclohexan-1-ol
CID 134996054
1-(2-cyclopropylethyl)-4,4-dimethylcyclohexan-1-ol
CID 106590452
3,3,5-trimethyl-1-(4-methylpentyl)cyclohexan-1-ol
CID 83157507
3,3,5-trimethyl-1-(oxan-4-ylmethyl)cyclohexan-1-ol
CID 65147877
1-(3-ethylsulfonylpropyl)-3,3,5-trimethylcyclohexan-1-ol
CID 65147372
1-[(1-hydroxycyclohexyl)methyl]-3,3,5-trimethylcyclohexan-1-ol
CID 91036468
2-[(1-hydroxy-3,3,5-trimethylcyclohexyl)methyl]prop-2-enoic acid
CID 166769451
1-(2-cyclopropylethyl)cyclopropan-1-ol
CID 91129908
3-amino-1-(2-cyclopropylethyl)cyclobutan-1-ol
CID 106590534
fluoromethane;1,3,3,5-tetramethylcyclohexan-1-ol
CID 142032504
4-(2-cyclopropylethyl)-2,2-dimethyloxan-4-ol
CID 106590447

Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclopropylethyl)-3,3,5-trimethylcyclohexan-1-ol?
The IUPAC name of 1-(2-cyclopropylethyl)-3,3,5-trimethylcyclohexan-1-ol (CID 106590352) is 1-(2-cyclopropylethyl)-3,3,5-trimethylcyclohexan-1-ol.
What is the SMILES notation for 1-(2-cyclopropylethyl)-3,3,5-trimethylcyclohexan-1-ol?
The canonical SMILES for 1-(2-cyclopropylethyl)-3,3,5-trimethylcyclohexan-1-ol is CC1CC(C)(C)CC(O)(CCC2CC2)C1.
What is the InChIKey of 1-(2-cyclopropylethyl)-3,3,5-trimethylcyclohexan-1-ol?
The InChIKey is WNGIJZRGHUDMDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26O/c1-11-8-13(2,3)10-14(15,9-11)7-6-12-4-5-12/h11-12,15H,4-10H2,1-3H3.
What are the key properties of 1-(2-cyclopropylethyl)-3,3,5-trimethylcyclohexan-1-ol?
1-(2-cyclopropylethyl)-3,3,5-trimethylcyclohexan-1-ol has a molecular weight of 210.36 g/mol, XLogP of 3.75, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclopropylethyl)-3,3,5-trimethylcyclohexan-1-ol is sourced from PubChem (CID 106590352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).