2-[methyl(2,2,2-trifluoroethyl)amino]cyclopentan-1-ol

C8H14F3NO — CID 60886977

IUPAC2-[methyl(2,2,2-trifluoroethyl)amino]cyclopentan-1-ol
SMILESCN(CC(F)(F)F)C1CCCC1O
InChIInChI=1S/C8H14F3NO/c1-12(5-8(9,10)11)6-3-2-4-7(6)13/h6-7,13H,2-5H2,1H3
InChIKeyPXTKNGVRUBKORI-UHFFFAOYSA-N
MW197.20 g/mol
LogP1.39
Rot. Bonds2

About 2-[methyl(2,2,2-trifluoroethyl)amino]cyclopentan-1-ol

2-[methyl(2,2,2-trifluoroethyl)amino]cyclopentan-1-ol (PubChem CID 60886977) has the molecular formula C8H14F3NO and a molecular weight of 197.20 g/mol. Its IUPAC name is 2-[methyl(2,2,2-trifluoroethyl)amino]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[methyl(2,2,2-trifluoroethyl)amino]cyclopentan-1-ol
PubChem CID60886977
Molecular FormulaC8H14F3NO
Molecular Weight197.20 g/mol
Exact Mass197.10
IUPAC Name2-[methyl(2,2,2-trifluoroethyl)amino]cyclopentan-1-ol
SMILESCN(CC(F)(F)F)C1CCCC1O
InChIInChI=1S/C8H14F3NO/c1-12(5-8(9,10)11)6-3-2-4-7(6)13/h6-7,13H,2-5H2,1H3
InChIKeyPXTKNGVRUBKORI-UHFFFAOYSA-N
XLogP1.39
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.20
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[methyl(2,2,2-trifluoroethyl)amino]cyclopentan-1-ol?
The IUPAC name of 2-[methyl(2,2,2-trifluoroethyl)amino]cyclopentan-1-ol (CID 60886977) is 2-[methyl(2,2,2-trifluoroethyl)amino]cyclopentan-1-ol.
What is the SMILES notation for 2-[methyl(2,2,2-trifluoroethyl)amino]cyclopentan-1-ol?
The canonical SMILES for 2-[methyl(2,2,2-trifluoroethyl)amino]cyclopentan-1-ol is CN(CC(F)(F)F)C1CCCC1O.
What is the InChIKey of 2-[methyl(2,2,2-trifluoroethyl)amino]cyclopentan-1-ol?
The InChIKey is PXTKNGVRUBKORI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14F3NO/c1-12(5-8(9,10)11)6-3-2-4-7(6)13/h6-7,13H,2-5H2,1H3.
What are the key properties of 2-[methyl(2,2,2-trifluoroethyl)amino]cyclopentan-1-ol?
2-[methyl(2,2,2-trifluoroethyl)amino]cyclopentan-1-ol has a molecular weight of 197.20 g/mol, XLogP of 1.39, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl(2,2,2-trifluoroethyl)amino]cyclopentan-1-ol is sourced from PubChem (CID 60886977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).