[1-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]cyclohexyl]methanol

C13H22F3NO — CID 62271121

IUPAC[1-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]cyclohexyl]methanol
SMILESOCC1(CN(CC(F)(F)F)C2CC2)CCCCC1
InChIInChI=1S/C13H22F3NO/c14-13(15,16)9-17(11-4-5-11)8-12(10-18)6-2-1-3-7-12/h11,18H,1-10H2
InChIKeyGYAXGEUYAUUNIC-UHFFFAOYSA-N
MW265.32 g/mol
LogP2.96
Rot. Bonds5

About [1-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]cyclohexyl]methanol

[1-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]cyclohexyl]methanol (PubChem CID 62271121) has the molecular formula C13H22F3NO and a molecular weight of 265.32 g/mol. Its IUPAC name is [1-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]cyclohexyl]methanol.

Molecular Properties

Compound Name[1-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]cyclohexyl]methanol
PubChem CID62271121
Molecular FormulaC13H22F3NO
Molecular Weight265.32 g/mol
Exact Mass265.17
IUPAC Name[1-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]cyclohexyl]methanol
SMILESOCC1(CN(CC(F)(F)F)C2CC2)CCCCC1
InChIInChI=1S/C13H22F3NO/c14-13(15,16)9-17(11-4-5-11)8-12(10-18)6-2-1-3-7-12/h11,18H,1-10H2
InChIKeyGYAXGEUYAUUNIC-UHFFFAOYSA-N
XLogP2.96
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [1-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]cyclohexyl]methanol?
The IUPAC name of [1-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]cyclohexyl]methanol (CID 62271121) is [1-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]cyclohexyl]methanol.
What is the SMILES notation for [1-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]cyclohexyl]methanol?
The canonical SMILES for [1-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]cyclohexyl]methanol is OCC1(CN(CC(F)(F)F)C2CC2)CCCCC1.
What is the InChIKey of [1-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]cyclohexyl]methanol?
The InChIKey is GYAXGEUYAUUNIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22F3NO/c14-13(15,16)9-17(11-4-5-11)8-12(10-18)6-2-1-3-7-12/h11,18H,1-10H2.
What are the key properties of [1-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]cyclohexyl]methanol?
[1-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]cyclohexyl]methanol has a molecular weight of 265.32 g/mol, XLogP of 2.96, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]cyclohexyl]methanol is sourced from PubChem (CID 62271121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).