[1-(2,2,2-trifluoroethylamino)cyclopentyl]methanol

C8H14F3NO — CID 61045463

IUPAC[1-(2,2,2-trifluoroethylamino)cyclopentyl]methanol
SMILESOCC1(NCC(F)(F)F)CCCC1
InChIInChI=1S/C8H14F3NO/c9-8(10,11)5-12-7(6-13)3-1-2-4-7/h12-13H,1-6H2
InChIKeyIVSUMJKXGOPJLQ-UHFFFAOYSA-N
MW197.20 g/mol
LogP1.44
Rot. Bonds3

About [1-(2,2,2-trifluoroethylamino)cyclopentyl]methanol

[1-(2,2,2-trifluoroethylamino)cyclopentyl]methanol (PubChem CID 61045463) has the molecular formula C8H14F3NO and a molecular weight of 197.20 g/mol. Its IUPAC name is [1-(2,2,2-trifluoroethylamino)cyclopentyl]methanol.

Molecular Properties

Compound Name[1-(2,2,2-trifluoroethylamino)cyclopentyl]methanol
PubChem CID61045463
Molecular FormulaC8H14F3NO
Molecular Weight197.20 g/mol
Exact Mass197.10
IUPAC Name[1-(2,2,2-trifluoroethylamino)cyclopentyl]methanol
SMILESOCC1(NCC(F)(F)F)CCCC1
InChIInChI=1S/C8H14F3NO/c9-8(10,11)5-12-7(6-13)3-1-2-4-7/h12-13H,1-6H2
InChIKeyIVSUMJKXGOPJLQ-UHFFFAOYSA-N
XLogP1.44
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.20
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [1-(2,2,2-trifluoroethylamino)cyclopentyl]methanol?
The IUPAC name of [1-(2,2,2-trifluoroethylamino)cyclopentyl]methanol (CID 61045463) is [1-(2,2,2-trifluoroethylamino)cyclopentyl]methanol.
What is the SMILES notation for [1-(2,2,2-trifluoroethylamino)cyclopentyl]methanol?
The canonical SMILES for [1-(2,2,2-trifluoroethylamino)cyclopentyl]methanol is OCC1(NCC(F)(F)F)CCCC1.
What is the InChIKey of [1-(2,2,2-trifluoroethylamino)cyclopentyl]methanol?
The InChIKey is IVSUMJKXGOPJLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14F3NO/c9-8(10,11)5-12-7(6-13)3-1-2-4-7/h12-13H,1-6H2.
What are the key properties of [1-(2,2,2-trifluoroethylamino)cyclopentyl]methanol?
[1-(2,2,2-trifluoroethylamino)cyclopentyl]methanol has a molecular weight of 197.20 g/mol, XLogP of 1.44, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,2,2-trifluoroethylamino)cyclopentyl]methanol is sourced from PubChem (CID 61045463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).