4-cyclohexyl-4-cyclopropyl-3-methylbutan-1-ol

C14H26O — CID 170161070

IUPAC4-cyclohexyl-4-cyclopropyl-3-methylbutan-1-ol
SMILESCC(CCO)C(C1CCCCC1)C1CC1
InChIInChI=1S/C14H26O/c1-11(9-10-15)14(13-7-8-13)12-5-3-2-4-6-12/h11-15H,2-10H2,1H3
InChIKeyWHOYGQSBHXBGNI-UHFFFAOYSA-N
MW210.36 g/mol
LogP3.61
Rot. Bonds5

About 4-cyclohexyl-4-cyclopropyl-3-methylbutan-1-ol

4-cyclohexyl-4-cyclopropyl-3-methylbutan-1-ol (PubChem CID 170161070) has the molecular formula C14H26O and a molecular weight of 210.36 g/mol. Its IUPAC name is 4-cyclohexyl-4-cyclopropyl-3-methylbutan-1-ol.

Molecular Properties

Compound Name4-cyclohexyl-4-cyclopropyl-3-methylbutan-1-ol
PubChem CID170161070
Molecular FormulaC14H26O
Molecular Weight210.36 g/mol
Exact Mass210.20
IUPAC Name4-cyclohexyl-4-cyclopropyl-3-methylbutan-1-ol
SMILESCC(CCO)C(C1CCCCC1)C1CC1
InChIInChI=1S/C14H26O/c1-11(9-10-15)14(13-7-8-13)12-5-3-2-4-6-12/h11-15H,2-10H2,1H3
InChIKeyWHOYGQSBHXBGNI-UHFFFAOYSA-N
XLogP3.61
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-cyclohexyl-4-methylpentan-1-ol
CID 121406245
(1R,2R)-1-cyclohexyl-2-methylpropane-1,3-diol
CID 12709664
(1-cycloheptadecyl-2-methylpropyl)cycloheptadecane
CID 123633331
(2R)-2-cyclohexylpropan-1-ol
CID 10176192
1,2,2-tricyclohexylethylcyclohexane
CID 59850833
4-amino-3-cycloheptyl-4-methylpentan-1-ol
CID 66092371
6-cyclohexyl-4-methylheptan-1-ol
CID 142413508
(3R)-3-(cyclopentylamino)butan-1-ol
CID 103854696
3-(1-cyclohexylethylamino)-4,4-dimethylpentan-1-ol
CID 113438636
3-(1-cyclopentylethylamino)-4-methylpentan-1-ol
CID 115724580
1-cyclohexyl-2-methylhex-5-en-1-ol
CID 142828670
3-cyclohexyl-3-(cyclopropylamino)propan-1-ol
CID 83818925

Frequently Asked Questions

What is the IUPAC name of 4-cyclohexyl-4-cyclopropyl-3-methylbutan-1-ol?
The IUPAC name of 4-cyclohexyl-4-cyclopropyl-3-methylbutan-1-ol (CID 170161070) is 4-cyclohexyl-4-cyclopropyl-3-methylbutan-1-ol.
What is the SMILES notation for 4-cyclohexyl-4-cyclopropyl-3-methylbutan-1-ol?
The canonical SMILES for 4-cyclohexyl-4-cyclopropyl-3-methylbutan-1-ol is CC(CCO)C(C1CCCCC1)C1CC1.
What is the InChIKey of 4-cyclohexyl-4-cyclopropyl-3-methylbutan-1-ol?
The InChIKey is WHOYGQSBHXBGNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26O/c1-11(9-10-15)14(13-7-8-13)12-5-3-2-4-6-12/h11-15H,2-10H2,1H3.
What are the key properties of 4-cyclohexyl-4-cyclopropyl-3-methylbutan-1-ol?
4-cyclohexyl-4-cyclopropyl-3-methylbutan-1-ol has a molecular weight of 210.36 g/mol, XLogP of 3.61, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyl-4-cyclopropyl-3-methylbutan-1-ol is sourced from PubChem (CID 170161070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).