4-methyl-1-[[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]methyl]cyclohexan-1-ol

C15H27F3N2O — CID 65117458

IUPAC4-methyl-1-[[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]methyl]cyclohexan-1-ol
SMILESCC1CCC(O)(CNC2CCN(CC(F)(F)F)CC2)CC1
InChIInChI=1S/C15H27F3N2O/c1-12-2-6-14(21,7-3-12)10-19-13-4-8-20(9-5-13)11-15(16,17)18/h12-13,19,21H,2-11H2,1H3
InChIKeyCUAGNWAOPOMABK-UHFFFAOYSA-N
MW308.39 g/mol
LogP2.54
Rot. Bonds4

About 4-methyl-1-[[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]methyl]cyclohexan-1-ol

4-methyl-1-[[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]methyl]cyclohexan-1-ol (PubChem CID 65117458) has the molecular formula C15H27F3N2O and a molecular weight of 308.39 g/mol. Its IUPAC name is 4-methyl-1-[[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name4-methyl-1-[[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]methyl]cyclohexan-1-ol
PubChem CID65117458
Molecular FormulaC15H27F3N2O
Molecular Weight308.39 g/mol
Exact Mass308.21
IUPAC Name4-methyl-1-[[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]methyl]cyclohexan-1-ol
SMILESCC1CCC(O)(CNC2CCN(CC(F)(F)F)CC2)CC1
InChIInChI=1S/C15H27F3N2O/c1-12-2-6-14(21,7-3-12)10-19-13-4-8-20(9-5-13)11-15(16,17)18/h12-13,19,21H,2-11H2,1H3
InChIKeyCUAGNWAOPOMABK-UHFFFAOYSA-N
XLogP2.54
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.39
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-methyl-1-[[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]methyl]cyclohexan-1-ol with MolForge

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Related Compounds

4-methyl-1-[[(1-propylazepan-4-yl)amino]methyl]cyclohexan-1-ol
CID 65115554
4-[[[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]amino]methyl]thian-4-ol
CID 75378829
1-[(cyclobutylamino)methyl]-4-methylcyclohexan-1-ol
CID 65115377
1-[(cyclopropylamino)methyl]-4-methylcycloheptan-1-ol
CID 65082633
N-prop-2-ynyl-1-(2,2,2-trifluoroethyl)piperidin-4-amine
CID 43755345
4-methyl-1-[(thian-4-ylamino)methyl]cyclohexan-1-ol
CID 65117892
ethane;4-methyl-1-(2,2,2-trifluoroethyl)piperidine
CID 142345486
4-[(cyclopropylamino)methyl]-1-ethylpiperidin-4-ol
CID 39240029
(3S)-3-methyl-1-(2,2,2-trifluoroethyl)pyrrolidine
CID 122495210
4-[[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]methyl]benzamide
CID 119107058
1-[[(2,2-dimethyl-1,3-dioxan-5-yl)amino]methyl]-4-methylcyclohexan-1-ol
CID 106658812
2,6-dimethyl-N-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]piperidin-1-amine
CID 83009533

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-[[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]methyl]cyclohexan-1-ol?
The IUPAC name of 4-methyl-1-[[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]methyl]cyclohexan-1-ol (CID 65117458) is 4-methyl-1-[[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]methyl]cyclohexan-1-ol.
What is the SMILES notation for 4-methyl-1-[[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]methyl]cyclohexan-1-ol?
The canonical SMILES for 4-methyl-1-[[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]methyl]cyclohexan-1-ol is CC1CCC(O)(CNC2CCN(CC(F)(F)F)CC2)CC1.
What is the InChIKey of 4-methyl-1-[[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]methyl]cyclohexan-1-ol?
The InChIKey is CUAGNWAOPOMABK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27F3N2O/c1-12-2-6-14(21,7-3-12)10-19-13-4-8-20(9-5-13)11-15(16,17)18/h12-13,19,21H,2-11H2,1H3.
What are the key properties of 4-methyl-1-[[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]methyl]cyclohexan-1-ol?
4-methyl-1-[[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]methyl]cyclohexan-1-ol has a molecular weight of 308.39 g/mol, XLogP of 2.54, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-[[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]methyl]cyclohexan-1-ol is sourced from PubChem (CID 65117458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).