2-piperidin-2-yl-N-[2-(2,2,2-trifluoroethoxy)ethyl]ethanesulfonamide

C11H21F3N2O3S — CID 63826566

IUPAC2-piperidin-2-yl-N-[2-(2,2,2-trifluoroethoxy)ethyl]ethanesulfonamide
SMILESO=S(=O)(CCC1CCCCN1)NCCOCC(F)(F)F
InChIInChI=1S/C11H21F3N2O3S/c12-11(13,14)9-19-7-6-16-20(17,18)8-4-10-3-1-2-5-15-10/h10,15-16H,1-9H2
InChIKeyFXPVCMUXGNMKCY-UHFFFAOYSA-N
MW318.36 g/mol
LogP1.02
Rot. Bonds8

About 2-piperidin-2-yl-N-[2-(2,2,2-trifluoroethoxy)ethyl]ethanesulfonamide

2-piperidin-2-yl-N-[2-(2,2,2-trifluoroethoxy)ethyl]ethanesulfonamide (PubChem CID 63826566) has the molecular formula C11H21F3N2O3S and a molecular weight of 318.36 g/mol. Its IUPAC name is 2-piperidin-2-yl-N-[2-(2,2,2-trifluoroethoxy)ethyl]ethanesulfonamide.

Molecular Properties

Compound Name2-piperidin-2-yl-N-[2-(2,2,2-trifluoroethoxy)ethyl]ethanesulfonamide
PubChem CID63826566
Molecular FormulaC11H21F3N2O3S
Molecular Weight318.36 g/mol
Exact Mass318.12
IUPAC Name2-piperidin-2-yl-N-[2-(2,2,2-trifluoroethoxy)ethyl]ethanesulfonamide
SMILESO=S(=O)(CCC1CCCCN1)NCCOCC(F)(F)F
InChIInChI=1S/C11H21F3N2O3S/c12-11(13,14)9-19-7-6-16-20(17,18)8-4-10-3-1-2-5-15-10/h10,15-16H,1-9H2
InChIKeyFXPVCMUXGNMKCY-UHFFFAOYSA-N
XLogP1.02
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.36
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-piperidin-2-yl-N-[2-(2,2,2-trifluoroethoxy)ethyl]ethanesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-[2-(cyclohexylamino)propoxy]ethyl]-1,1-difluoromethanesulfonamide
CID 169661758
N-ethyl-2-piperidin-2-yl-N-(2,2,2-trifluoroethyl)ethanesulfonamide
CID 55009154
2-methoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)ethanesulfonamide
CID 55009641
1-piperidin-4-yl-N-[2-(2,2,2-trifluoroethoxy)ethyl]methanesulfonamide
CID 55262238
2-piperidin-2-yl-N-(2,2,2-trifluoroethyl)ethanesulfonamide
CID 60864187
N-methyl-2-piperidin-2-yl-N-(2,2,2-trifluoroethyl)ethanesulfonamide
CID 60891219
1-methylsulfonyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]piperidin-4-amine
CID 61490880
2-piperidin-2-yl-N-propyl-N-(2,2,2-trifluoroethyl)ethanesulfonamide
CID 61606315
2-piperidin-2-yl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)ethanesulfonamide
CID 61606342
N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)oxane-4-sulfonamide
CID 62049544
2-piperidin-2-yl-N-(3,3,3-trifluoropropyl)ethanesulfonamide
CID 63227887
1-piperidin-2-yl-N-(3,3,3-trifluoropropyl)methanesulfonamide
CID 63227994

Frequently Asked Questions

What is the IUPAC name of 2-piperidin-2-yl-N-[2-(2,2,2-trifluoroethoxy)ethyl]ethanesulfonamide?
The IUPAC name of 2-piperidin-2-yl-N-[2-(2,2,2-trifluoroethoxy)ethyl]ethanesulfonamide (CID 63826566) is 2-piperidin-2-yl-N-[2-(2,2,2-trifluoroethoxy)ethyl]ethanesulfonamide.
What is the SMILES notation for 2-piperidin-2-yl-N-[2-(2,2,2-trifluoroethoxy)ethyl]ethanesulfonamide?
The canonical SMILES for 2-piperidin-2-yl-N-[2-(2,2,2-trifluoroethoxy)ethyl]ethanesulfonamide is O=S(=O)(CCC1CCCCN1)NCCOCC(F)(F)F.
What is the InChIKey of 2-piperidin-2-yl-N-[2-(2,2,2-trifluoroethoxy)ethyl]ethanesulfonamide?
The InChIKey is FXPVCMUXGNMKCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21F3N2O3S/c12-11(13,14)9-19-7-6-16-20(17,18)8-4-10-3-1-2-5-15-10/h10,15-16H,1-9H2.
What are the key properties of 2-piperidin-2-yl-N-[2-(2,2,2-trifluoroethoxy)ethyl]ethanesulfonamide?
2-piperidin-2-yl-N-[2-(2,2,2-trifluoroethoxy)ethyl]ethanesulfonamide has a molecular weight of 318.36 g/mol, XLogP of 1.02, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperidin-2-yl-N-[2-(2,2,2-trifluoroethoxy)ethyl]ethanesulfonamide is sourced from PubChem (CID 63826566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).