3-[[[2-(trifluoromethyl)cyclohexyl]amino]methyl]cyclopentan-1-ol

C13H22F3NO — CID 106121092

IUPAC3-[[[2-(trifluoromethyl)cyclohexyl]amino]methyl]cyclopentan-1-ol
SMILESOC1CCC(CNC2CCCCC2C(F)(F)F)C1
InChIInChI=1S/C13H22F3NO/c14-13(15,16)11-3-1-2-4-12(11)17-8-9-5-6-10(18)7-9/h9-12,17-18H,1-8H2
InChIKeyKNKHWJOTNBJXRJ-UHFFFAOYSA-N
MW265.32 g/mol
LogP2.86
Rot. Bonds3

About 3-[[[2-(trifluoromethyl)cyclohexyl]amino]methyl]cyclopentan-1-ol

3-[[[2-(trifluoromethyl)cyclohexyl]amino]methyl]cyclopentan-1-ol (PubChem CID 106121092) has the molecular formula C13H22F3NO and a molecular weight of 265.32 g/mol. Its IUPAC name is 3-[[[2-(trifluoromethyl)cyclohexyl]amino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name3-[[[2-(trifluoromethyl)cyclohexyl]amino]methyl]cyclopentan-1-ol
PubChem CID106121092
Molecular FormulaC13H22F3NO
Molecular Weight265.32 g/mol
Exact Mass265.17
IUPAC Name3-[[[2-(trifluoromethyl)cyclohexyl]amino]methyl]cyclopentan-1-ol
SMILESOC1CCC(CNC2CCCCC2C(F)(F)F)C1
InChIInChI=1S/C13H22F3NO/c14-13(15,16)11-3-1-2-4-12(11)17-8-9-5-6-10(18)7-9/h9-12,17-18H,1-8H2
InChIKeyKNKHWJOTNBJXRJ-UHFFFAOYSA-N
XLogP2.86
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
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

Analyze 3-[[[2-(trifluoromethyl)cyclohexyl]amino]methyl]cyclopentan-1-ol with MolForge

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Related Compounds

3-[[2-(Trifluoromethyl)cyclohexyl]amino]cyclohexan-1-ol
CID 64758277
4-[[2-(Trifluoromethyl)cyclohexyl]amino]cyclohexan-1-ol
CID 64758465
2-[[[3-(Trifluoromethyl)cyclohexyl]amino]methyl]cyclopentan-1-ol
CID 65832861
2-[[[4-(Trifluoromethyl)cyclohexyl]amino]methyl]cyclopentan-1-ol
CID 65833222
2-[[[2-(Trifluoromethyl)cyclohexyl]amino]methyl]cyclopentan-1-ol
CID 65833757
[2-[[[2-(Trifluoromethyl)cyclohexyl]amino]methyl]cyclopentyl]methanol
CID 65926432
3-[[[2-(Trifluoromethyl)cyclohexyl]amino]methyl]cyclobutan-1-ol
CID 66005857
3-Methyl-4-[[2-(trifluoromethyl)cyclohexyl]amino]butan-1-ol
CID 66092509
3-[[[2-(Trifluoromethyl)cyclohexyl]amino]methyl]pentan-1-ol
CID 80298470
4-[[2-(Trifluoromethyl)cyclohexyl]amino]pentan-1-ol
CID 80301318
(2S,4S)-4-methyl-5-[[(1R,3S)-3-(trifluoromethyl)cyclohexyl]amino]pentan-2-ol
CID 99627295
3-[[[3-(Trifluoromethyl)cyclohexyl]amino]methyl]cyclopentan-1-ol
CID 103270732

Frequently Asked Questions

What is the IUPAC name of 3-[[[2-(trifluoromethyl)cyclohexyl]amino]methyl]cyclopentan-1-ol?
The IUPAC name of 3-[[[2-(trifluoromethyl)cyclohexyl]amino]methyl]cyclopentan-1-ol (CID 106121092) is 3-[[[2-(trifluoromethyl)cyclohexyl]amino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 3-[[[2-(trifluoromethyl)cyclohexyl]amino]methyl]cyclopentan-1-ol?
The canonical SMILES for 3-[[[2-(trifluoromethyl)cyclohexyl]amino]methyl]cyclopentan-1-ol is OC1CCC(CNC2CCCCC2C(F)(F)F)C1.
What is the InChIKey of 3-[[[2-(trifluoromethyl)cyclohexyl]amino]methyl]cyclopentan-1-ol?
The InChIKey is KNKHWJOTNBJXRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22F3NO/c14-13(15,16)11-3-1-2-4-12(11)17-8-9-5-6-10(18)7-9/h9-12,17-18H,1-8H2.
What are the key properties of 3-[[[2-(trifluoromethyl)cyclohexyl]amino]methyl]cyclopentan-1-ol?
3-[[[2-(trifluoromethyl)cyclohexyl]amino]methyl]cyclopentan-1-ol has a molecular weight of 265.32 g/mol, XLogP of 2.86, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[[2-(trifluoromethyl)cyclohexyl]amino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 106121092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).