1-(cyclohexylmethyl)piperidin-4-ol;trifluoromethanol

C13H24F3NO2 — CID 157039193

IUPAC1-(cyclohexylmethyl)piperidin-4-ol;trifluoromethanol
SMILESOC(F)(F)F.OC1CCN(CC2CCCCC2)CC1
InChIInChI=1S/C12H23NO.CHF3O/c14-12-6-8-13(9-7-12)10-11-4-2-1-3-5-11;2-1(3,4)5/h11-12,14H,1-10H2;5H
InChIKeyLVISBJCIMIEHBX-UHFFFAOYSA-N
MW283.33 g/mol
LogP2.52
Rot. Bonds2

About 1-(cyclohexylmethyl)piperidin-4-ol;trifluoromethanol

1-(cyclohexylmethyl)piperidin-4-ol;trifluoromethanol (PubChem CID 157039193) has the molecular formula C13H24F3NO2 and a molecular weight of 283.33 g/mol. Its IUPAC name is 1-(cyclohexylmethyl)piperidin-4-ol;trifluoromethanol.

Molecular Properties

Compound Name1-(cyclohexylmethyl)piperidin-4-ol;trifluoromethanol
PubChem CID157039193
Molecular FormulaC13H24F3NO2
Molecular Weight283.33 g/mol
Exact Mass283.18
IUPAC Name1-(cyclohexylmethyl)piperidin-4-ol;trifluoromethanol
SMILESOC(F)(F)F.OC1CCN(CC2CCCCC2)CC1
InChIInChI=1S/C12H23NO.CHF3O/c14-12-6-8-13(9-7-12)10-11-4-2-1-3-5-11;2-1(3,4)5/h11-12,14H,1-10H2;5H
InChIKeyLVISBJCIMIEHBX-UHFFFAOYSA-N
XLogP2.52
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(cyclopropylmethyl)piperidin-4-ol
CID 21428752
1-(cyclopentylmethyl)pyrrolidin-3-ol
CID 62916815
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CID 157039213
1-[[(3R)-1-methylpiperidin-3-yl]methyl]piperidin-4-ol
CID 156719953
1-[4-(cyclohexylmethyl)-1,4-diazepan-1-yl]-2-methylpropan-2-ol
CID 99639323
1-(cyclohexylmethyl)piperidine;ethane;ethanol
CID 143571293
1-(cyclohexylmethyl)-4-propylazepane
CID 70936958
ethane;1-[(1-methylpiperidin-4-yl)methyl]piperidin-4-ol;propane
CID 168901872
4-(cyclohexylmethyl)morpholine
CID 641545
[1-(cyclohexylmethyl)pyrrolidin-3-yl]methanol
CID 44558451
1-tert-butyl-4-(cyclohexylmethyl)piperazine
CID 157130217
1-(cyclobutylmethyl)azetidine
CID 89347168

Frequently Asked Questions

What is the IUPAC name of 1-(cyclohexylmethyl)piperidin-4-ol;trifluoromethanol?
The IUPAC name of 1-(cyclohexylmethyl)piperidin-4-ol;trifluoromethanol (CID 157039193) is 1-(cyclohexylmethyl)piperidin-4-ol;trifluoromethanol.
What is the SMILES notation for 1-(cyclohexylmethyl)piperidin-4-ol;trifluoromethanol?
The canonical SMILES for 1-(cyclohexylmethyl)piperidin-4-ol;trifluoromethanol is OC(F)(F)F.OC1CCN(CC2CCCCC2)CC1.
What is the InChIKey of 1-(cyclohexylmethyl)piperidin-4-ol;trifluoromethanol?
The InChIKey is LVISBJCIMIEHBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO.CHF3O/c14-12-6-8-13(9-7-12)10-11-4-2-1-3-5-11;2-1(3,4)5/h11-12,14H,1-10H2;5H.
What are the key properties of 1-(cyclohexylmethyl)piperidin-4-ol;trifluoromethanol?
1-(cyclohexylmethyl)piperidin-4-ol;trifluoromethanol has a molecular weight of 283.33 g/mol, XLogP of 2.52, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclohexylmethyl)piperidin-4-ol;trifluoromethanol is sourced from PubChem (CID 157039193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).