[3-(trifluoromethoxy)cyclobutyl]methanesulfonamide

C6H10F3NO3S — CID 167725529

IUPAC[3-(trifluoromethoxy)cyclobutyl]methanesulfonamide
SMILESNS(=O)(=O)CC1CC(OC(F)(F)F)C1
InChIInChI=1S/C6H10F3NO3S/c7-6(8,9)13-5-1-4(2-5)3-14(10,11)12/h4-5H,1-3H2,(H2,10,11,12)
InChIKeyFHXAHRASKVVXTO-UHFFFAOYSA-N
MW233.21 g/mol
LogP0.59
Rot. Bonds3

About [3-(trifluoromethoxy)cyclobutyl]methanesulfonamide

[3-(trifluoromethoxy)cyclobutyl]methanesulfonamide (PubChem CID 167725529) has the molecular formula C6H10F3NO3S and a molecular weight of 233.21 g/mol. Its IUPAC name is [3-(trifluoromethoxy)cyclobutyl]methanesulfonamide.

Molecular Properties

Compound Name[3-(trifluoromethoxy)cyclobutyl]methanesulfonamide
PubChem CID167725529
Molecular FormulaC6H10F3NO3S
Molecular Weight233.21 g/mol
Exact Mass233.03
IUPAC Name[3-(trifluoromethoxy)cyclobutyl]methanesulfonamide
SMILESNS(=O)(=O)CC1CC(OC(F)(F)F)C1
InChIInChI=1S/C6H10F3NO3S/c7-6(8,9)13-5-1-4(2-5)3-14(10,11)12/h4-5H,1-3H2,(H2,10,11,12)
InChIKeyFHXAHRASKVVXTO-UHFFFAOYSA-N
XLogP0.59
TPSA69.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.21
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3-(Trifluoromethoxy)cyclobutyl)methanesulfonyl chloride
CID 165665291
[2-(Trifluoromethoxy)cyclobutyl]methanesulfonyl chloride
CID 123323226
1,1,1-Trifluoro-4-methoxy-3-methylbutane-2-sulfonamide
CID 114827627
[3-Methoxy-3-(trifluoromethyl)cyclobutyl]methanesulfonamide
CID 165886228
3-Methoxy-3-(trifluoromethyl)cyclobutane-1-sulfonamide
CID 165894357
2-(3,3-Difluorocyclobutyl)-2-methoxyethane-1-sulfonamide
CID 165894991
[3-(Trifluoromethoxy)cyclobutyl]methanesulfonyl fluoride
CID 165981590
(3-Methoxycyclobutyl)methanesulfonamide
CID 165443561
rac-[(1R,2R)-2-methoxycyclobutyl]methanesulfonamide
CID 165887188
(3-Ethoxycyclobutyl)methanesulfonamide
CID 167737822

Frequently Asked Questions

What is the IUPAC name of [3-(trifluoromethoxy)cyclobutyl]methanesulfonamide?
The IUPAC name of [3-(trifluoromethoxy)cyclobutyl]methanesulfonamide (CID 167725529) is [3-(trifluoromethoxy)cyclobutyl]methanesulfonamide.
What is the SMILES notation for [3-(trifluoromethoxy)cyclobutyl]methanesulfonamide?
The canonical SMILES for [3-(trifluoromethoxy)cyclobutyl]methanesulfonamide is NS(=O)(=O)CC1CC(OC(F)(F)F)C1.
What is the InChIKey of [3-(trifluoromethoxy)cyclobutyl]methanesulfonamide?
The InChIKey is FHXAHRASKVVXTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10F3NO3S/c7-6(8,9)13-5-1-4(2-5)3-14(10,11)12/h4-5H,1-3H2,(H2,10,11,12).
What are the key properties of [3-(trifluoromethoxy)cyclobutyl]methanesulfonamide?
[3-(trifluoromethoxy)cyclobutyl]methanesulfonamide has a molecular weight of 233.21 g/mol, XLogP of 0.59, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(trifluoromethoxy)cyclobutyl]methanesulfonamide is sourced from PubChem (CID 167725529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).