1-(4-methylpiperidin-2-yl)-4-(trifluoromethyl)cyclohexan-1-ol

C13H22F3NO — CID 64756319

IUPAC1-(4-methylpiperidin-2-yl)-4-(trifluoromethyl)cyclohexan-1-ol
SMILESCC1CCNC(C2(O)CCC(C(F)(F)F)CC2)C1
InChIInChI=1S/C13H22F3NO/c1-9-4-7-17-11(8-9)12(18)5-2-10(3-6-12)13(14,15)16/h9-11,17-18H,2-8H2,1H3
InChIKeyMPCGVIIVFUVSBB-UHFFFAOYSA-N
MW265.32 g/mol
LogP2.86
Rot. Bonds1

About 1-(4-methylpiperidin-2-yl)-4-(trifluoromethyl)cyclohexan-1-ol

1-(4-methylpiperidin-2-yl)-4-(trifluoromethyl)cyclohexan-1-ol (PubChem CID 64756319) has the molecular formula C13H22F3NO and a molecular weight of 265.32 g/mol. Its IUPAC name is 1-(4-methylpiperidin-2-yl)-4-(trifluoromethyl)cyclohexan-1-ol.

Molecular Properties

Compound Name1-(4-methylpiperidin-2-yl)-4-(trifluoromethyl)cyclohexan-1-ol
PubChem CID64756319
Molecular FormulaC13H22F3NO
Molecular Weight265.32 g/mol
Exact Mass265.17
IUPAC Name1-(4-methylpiperidin-2-yl)-4-(trifluoromethyl)cyclohexan-1-ol
SMILESCC1CCNC(C2(O)CCC(C(F)(F)F)CC2)C1
InChIInChI=1S/C13H22F3NO/c1-9-4-7-17-11(8-9)12(18)5-2-10(3-6-12)13(14,15)16/h9-11,17-18H,2-8H2,1H3
InChIKeyMPCGVIIVFUVSBB-UHFFFAOYSA-N
XLogP2.86
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 52.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(Propan-2-ylamino)methyl]-3-(trifluoromethyl)cyclohexan-1-ol
CID 64758875
4,4-Difluoro-1-[1-(methylamino)ethyl]cyclohexan-1-ol
CID 134570750
4-[(Propan-2-ylamino)methyl]-1-(trifluoromethyl)cyclohexan-1-ol
CID 166157735
4,4-Difluoro-1-[(propan-2-ylamino)methyl]cyclohexan-1-ol
CID 177955087
1,1,1-Trifluoro-2-(piperidin-2-yl)propan-2-ol
CID 50987532
(2R)-1,1,1-trifluoro-2-[(2S)-piperidin-2-yl]propan-2-ol
CID 52421274
(2S)-1,1,1-trifluoro-2-[(2S)-piperidin-2-yl]propan-2-ol
CID 52421276
(2R)-1,1,1-trifluoro-2-[(2R)-piperidin-2-yl]propan-2-ol
CID 52421278
(2S)-1,1,1-trifluoro-2-[(2R)-piperidin-2-yl]propan-2-ol
CID 52421280
1-[[[1-(2,2,2-Trifluoroethyl)piperidin-4-yl]amino]methyl]cyclohexan-1-ol
CID 64058660
1-Pyrrolidin-2-yl-4-(trifluoromethyl)cyclohexan-1-ol
CID 64754302
1-Piperidin-2-yl-4-(trifluoromethyl)cyclohexan-1-ol
CID 64756508

Frequently Asked Questions

What is the IUPAC name of 1-(4-methylpiperidin-2-yl)-4-(trifluoromethyl)cyclohexan-1-ol?
The IUPAC name of 1-(4-methylpiperidin-2-yl)-4-(trifluoromethyl)cyclohexan-1-ol (CID 64756319) is 1-(4-methylpiperidin-2-yl)-4-(trifluoromethyl)cyclohexan-1-ol.
What is the SMILES notation for 1-(4-methylpiperidin-2-yl)-4-(trifluoromethyl)cyclohexan-1-ol?
The canonical SMILES for 1-(4-methylpiperidin-2-yl)-4-(trifluoromethyl)cyclohexan-1-ol is CC1CCNC(C2(O)CCC(C(F)(F)F)CC2)C1.
What is the InChIKey of 1-(4-methylpiperidin-2-yl)-4-(trifluoromethyl)cyclohexan-1-ol?
The InChIKey is MPCGVIIVFUVSBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22F3NO/c1-9-4-7-17-11(8-9)12(18)5-2-10(3-6-12)13(14,15)16/h9-11,17-18H,2-8H2,1H3.
What are the key properties of 1-(4-methylpiperidin-2-yl)-4-(trifluoromethyl)cyclohexan-1-ol?
1-(4-methylpiperidin-2-yl)-4-(trifluoromethyl)cyclohexan-1-ol has a molecular weight of 265.32 g/mol, XLogP of 2.86, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylpiperidin-2-yl)-4-(trifluoromethyl)cyclohexan-1-ol is sourced from PubChem (CID 64756319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).