2-[cyclopentylmethyl(2,2,2-trifluoroethyl)amino]ethanol

C10H18F3NO — CID 103864876

IUPAC2-[cyclopentylmethyl(2,2,2-trifluoroethyl)amino]ethanol
SMILESOCCN(CC1CCCC1)CC(F)(F)F
InChIInChI=1S/C10H18F3NO/c11-10(12,13)8-14(5-6-15)7-9-3-1-2-4-9/h9,15H,1-8H2
InChIKeyXTDYUDCLBOKSOF-UHFFFAOYSA-N
MW225.25 g/mol
LogP2.03
Rot. Bonds5

About 2-[cyclopentylmethyl(2,2,2-trifluoroethyl)amino]ethanol

2-[cyclopentylmethyl(2,2,2-trifluoroethyl)amino]ethanol (PubChem CID 103864876) has the molecular formula C10H18F3NO and a molecular weight of 225.25 g/mol. Its IUPAC name is 2-[cyclopentylmethyl(2,2,2-trifluoroethyl)amino]ethanol.

Molecular Properties

Compound Name2-[cyclopentylmethyl(2,2,2-trifluoroethyl)amino]ethanol
PubChem CID103864876
Molecular FormulaC10H18F3NO
Molecular Weight225.25 g/mol
Exact Mass225.13
IUPAC Name2-[cyclopentylmethyl(2,2,2-trifluoroethyl)amino]ethanol
SMILESOCCN(CC1CCCC1)CC(F)(F)F
InChIInChI=1S/C10H18F3NO/c11-10(12,13)8-14(5-6-15)7-9-3-1-2-4-9/h9,15H,1-8H2
InChIKeyXTDYUDCLBOKSOF-UHFFFAOYSA-N
XLogP2.03
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(3R)-3-(2-fluoroethyl)pyrrolidin-1-yl]ethanol
CID 140293700
2-[3-(3,3-Difluoropropyl)pyrrolidin-1-yl]ethanol
CID 141084251
2-[3-(3,3-Difluoropentyl)pyrrolidin-1-yl]ethanol
CID 141084252
2-(4-Ethyl-3,3-difluoropyrrolidin-1-yl)ethanol
CID 163379532
2-(3,3-Difluoro-4-propan-2-ylpyrrolidin-1-yl)ethanol
CID 163381002
Ethane;2-(4-ethyl-3,3-difluoropyrrolidin-1-yl)ethanol
CID 170603780
2-[Cyclopentylmethyl-[2-(2,2,2-trifluoroethoxy)ethyl]amino]ethanol
CID 60302209
3-[Cyclopentylmethyl(methyl)amino]-1,1,1-trifluoropropan-2-ol
CID 63901039
2-[[3-(Aminomethyl)cyclopentyl]methyl-(2,2,2-trifluoroethyl)amino]ethanol
CID 83980414
2-[Cyclobutylmethyl(2,2,2-trifluoroethyl)amino]ethanol
CID 103734629
1-[[2-Hydroxyethyl(2,2,2-trifluoroethyl)amino]methyl]cyclopentan-1-ol
CID 103857837
2-[2-Cyclopropylethyl(2,2,2-trifluoroethyl)amino]ethanol
CID 103864995

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentylmethyl(2,2,2-trifluoroethyl)amino]ethanol?
The IUPAC name of 2-[cyclopentylmethyl(2,2,2-trifluoroethyl)amino]ethanol (CID 103864876) is 2-[cyclopentylmethyl(2,2,2-trifluoroethyl)amino]ethanol.
What is the SMILES notation for 2-[cyclopentylmethyl(2,2,2-trifluoroethyl)amino]ethanol?
The canonical SMILES for 2-[cyclopentylmethyl(2,2,2-trifluoroethyl)amino]ethanol is OCCN(CC1CCCC1)CC(F)(F)F.
What is the InChIKey of 2-[cyclopentylmethyl(2,2,2-trifluoroethyl)amino]ethanol?
The InChIKey is XTDYUDCLBOKSOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F3NO/c11-10(12,13)8-14(5-6-15)7-9-3-1-2-4-9/h9,15H,1-8H2.
What are the key properties of 2-[cyclopentylmethyl(2,2,2-trifluoroethyl)amino]ethanol?
2-[cyclopentylmethyl(2,2,2-trifluoroethyl)amino]ethanol has a molecular weight of 225.25 g/mol, XLogP of 2.03, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentylmethyl(2,2,2-trifluoroethyl)amino]ethanol is sourced from PubChem (CID 103864876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).