[2-hydroxyethyl(2,2,2-trifluoroethylsulfamoyl)amino]cyclopentane

C9H17F3N2O3S — CID 114809431

IUPAC[2-hydroxyethyl(2,2,2-trifluoroethylsulfamoyl)amino]cyclopentane
SMILESO=S(=O)(NCC(F)(F)F)N(CCO)C1CCCC1
InChIInChI=1S/C9H17F3N2O3S/c10-9(11,12)7-13-18(16,17)14(5-6-15)8-3-1-2-4-8/h8,13,15H,1-7H2
InChIKeyXADNQWSDRXVQBC-UHFFFAOYSA-N
MW290.31 g/mol
LogP0.62
Rot. Bonds6

About [2-hydroxyethyl(2,2,2-trifluoroethylsulfamoyl)amino]cyclopentane

[2-hydroxyethyl(2,2,2-trifluoroethylsulfamoyl)amino]cyclopentane (PubChem CID 114809431) has the molecular formula C9H17F3N2O3S and a molecular weight of 290.31 g/mol. Its IUPAC name is [2-hydroxyethyl(2,2,2-trifluoroethylsulfamoyl)amino]cyclopentane.

Molecular Properties

Compound Name[2-hydroxyethyl(2,2,2-trifluoroethylsulfamoyl)amino]cyclopentane
PubChem CID114809431
Molecular FormulaC9H17F3N2O3S
Molecular Weight290.31 g/mol
Exact Mass290.09
IUPAC Name[2-hydroxyethyl(2,2,2-trifluoroethylsulfamoyl)amino]cyclopentane
SMILESO=S(=O)(NCC(F)(F)F)N(CCO)C1CCCC1
InChIInChI=1S/C9H17F3N2O3S/c10-9(11,12)7-13-18(16,17)14(5-6-15)8-3-1-2-4-8/h8,13,15H,1-7H2
InChIKeyXADNQWSDRXVQBC-UHFFFAOYSA-N
XLogP0.62
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.31
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(aminomethyl)-2-[ethyl(2,2,2-trifluoroethylsulfamoyl)amino]cyclohexane
CID 114810983
1-cyclohexyl-1-(2-hydroxyethyl)-3-(2,2,2-trifluoroethyl)urea
CID 115620424
propan-2-yl N-[cyclopentyl(2-hydroxyethyl)sulfamoyl]carbamate
CID 114464161
N-cyclobutyl-N-(2-hydroxyethyl)-2,2-dimethylpropane-1-sulfonamide
CID 102867644
2-[cyclobutyl(dipropylsulfamoyl)amino]ethanol
CID 102675795
propan-2-yl N-[cyclobutyl(2-hydroxyethyl)sulfamoyl]carbamate
CID 102867663
4-amino-N-cyclobutyl-2,6-difluoro-N-(2-hydroxyethyl)benzenesulfonamide
CID 102859183
N-cyclobutyl-N-(2-hydroxyethyl)propane-2-sulfonamide
CID 102675881
[2-(2,2,2-trifluoroethylsulfamoylamino)cyclohexyl]methanol
CID 106543952
3-chloro-N-cyclopentyl-N-(2-hydroxyethyl)propane-1-sulfonamide
CID 60958952
2-amino-N-cyclobutyl-N-(2-hydroxyethyl)ethanesulfonamide
CID 102861399
2-[[butyl(2,2,2-trifluoroethylsulfamoyl)amino]methyl]pyrrolidine
CID 106609173

Frequently Asked Questions

What is the IUPAC name of [2-hydroxyethyl(2,2,2-trifluoroethylsulfamoyl)amino]cyclopentane?
The IUPAC name of [2-hydroxyethyl(2,2,2-trifluoroethylsulfamoyl)amino]cyclopentane (CID 114809431) is [2-hydroxyethyl(2,2,2-trifluoroethylsulfamoyl)amino]cyclopentane.
What is the SMILES notation for [2-hydroxyethyl(2,2,2-trifluoroethylsulfamoyl)amino]cyclopentane?
The canonical SMILES for [2-hydroxyethyl(2,2,2-trifluoroethylsulfamoyl)amino]cyclopentane is O=S(=O)(NCC(F)(F)F)N(CCO)C1CCCC1.
What is the InChIKey of [2-hydroxyethyl(2,2,2-trifluoroethylsulfamoyl)amino]cyclopentane?
The InChIKey is XADNQWSDRXVQBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17F3N2O3S/c10-9(11,12)7-13-18(16,17)14(5-6-15)8-3-1-2-4-8/h8,13,15H,1-7H2.
What are the key properties of [2-hydroxyethyl(2,2,2-trifluoroethylsulfamoyl)amino]cyclopentane?
[2-hydroxyethyl(2,2,2-trifluoroethylsulfamoyl)amino]cyclopentane has a molecular weight of 290.31 g/mol, XLogP of 0.62, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-hydroxyethyl(2,2,2-trifluoroethylsulfamoyl)amino]cyclopentane is sourced from PubChem (CID 114809431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).