N,N-dimethyl-4-(trifluoromethyl)piperidine-1-sulfonamide

C8H15F3N2O2S — CID 127364964

IUPACN,N-dimethyl-4-(trifluoromethyl)piperidine-1-sulfonamide
SMILESCN(C)S(=O)(=O)N1CCC(C(F)(F)F)CC1
InChIInChI=1S/C8H15F3N2O2S/c1-12(2)16(14,15)13-5-3-7(4-6-13)8(9,10)11/h7H,3-6H2,1-2H3
InChIKeyUBQNJBVLORUYIB-UHFFFAOYSA-N
MW260.28 g/mol
LogP1.07
Rot. Bonds2

About N,N-dimethyl-4-(trifluoromethyl)piperidine-1-sulfonamide

N,N-dimethyl-4-(trifluoromethyl)piperidine-1-sulfonamide (PubChem CID 127364964) has the molecular formula C8H15F3N2O2S and a molecular weight of 260.28 g/mol. Its IUPAC name is N,N-dimethyl-4-(trifluoromethyl)piperidine-1-sulfonamide.

Molecular Properties

Compound NameN,N-dimethyl-4-(trifluoromethyl)piperidine-1-sulfonamide
PubChem CID127364964
Molecular FormulaC8H15F3N2O2S
Molecular Weight260.28 g/mol
Exact Mass260.08
IUPAC NameN,N-dimethyl-4-(trifluoromethyl)piperidine-1-sulfonamide
SMILESCN(C)S(=O)(=O)N1CCC(C(F)(F)F)CC1
InChIInChI=1S/C8H15F3N2O2S/c1-12(2)16(14,15)13-5-3-7(4-6-13)8(9,10)11/h7H,3-6H2,1-2H3
InChIKeyUBQNJBVLORUYIB-UHFFFAOYSA-N
XLogP1.07
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.28
LogP ≤ 51.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(Trifluoromethyl)piperidine-1-sulfonyl chloride
CID 65535206
N,N,4-trimethylpiperidine-1-sulfonamide
CID 224932
3-methyl-N-(trifluoromethyl)piperidine-1-sulfonamide
CID 22008409
3,5-Dimethyl-1-(trifluoromethylsulfonyl)piperidine
CID 23227866
4-(Trifluoromethyl)piperidine-1-sulfonamide
CID 58349803
4-Methyl-1-(trifluoromethylsulfonyl)piperidine
CID 59862807
1-Methylsulfonyl-4-(trifluoromethyl)piperidine
CID 65545889
4-Ethyl-1-(trifluoromethylsulfonyl)piperidine
CID 68261275
3-(Trifluoromethyl)piperidine-1-sulfinate
CID 71259892
4-(Trifluoromethyl)piperidine-1-sulfinate
CID 122647034
N-propan-2-yl-4-(trifluoromethyl)piperidine-1-sulfonamide
CID 127770386
N-methyl-4-(trifluoromethyl)piperidine-1-sulfonamide
CID 128360905

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-(trifluoromethyl)piperidine-1-sulfonamide?
The IUPAC name of N,N-dimethyl-4-(trifluoromethyl)piperidine-1-sulfonamide (CID 127364964) is N,N-dimethyl-4-(trifluoromethyl)piperidine-1-sulfonamide.
What is the SMILES notation for N,N-dimethyl-4-(trifluoromethyl)piperidine-1-sulfonamide?
The canonical SMILES for N,N-dimethyl-4-(trifluoromethyl)piperidine-1-sulfonamide is CN(C)S(=O)(=O)N1CCC(C(F)(F)F)CC1.
What is the InChIKey of N,N-dimethyl-4-(trifluoromethyl)piperidine-1-sulfonamide?
The InChIKey is UBQNJBVLORUYIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15F3N2O2S/c1-12(2)16(14,15)13-5-3-7(4-6-13)8(9,10)11/h7H,3-6H2,1-2H3.
What are the key properties of N,N-dimethyl-4-(trifluoromethyl)piperidine-1-sulfonamide?
N,N-dimethyl-4-(trifluoromethyl)piperidine-1-sulfonamide has a molecular weight of 260.28 g/mol, XLogP of 1.07, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-(trifluoromethyl)piperidine-1-sulfonamide is sourced from PubChem (CID 127364964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).