(3,3-difluorocyclobutyl)methanesulfonamide

C5H9F2NO2S — CID 130920053

IUPAC(3,3-difluorocyclobutyl)methanesulfonamide
SMILESNS(=O)(=O)CC1CC(F)(F)C1
InChIInChI=1S/C5H9F2NO2S/c6-5(7)1-4(2-5)3-11(8,9)10/h4H,1-3H2,(H2,8,9,10)
InChIKeyZSRXSEVVBUGDJA-UHFFFAOYSA-N
MW185.19 g/mol
LogP0.32
Rot. Bonds2

About (3,3-difluorocyclobutyl)methanesulfonamide

(3,3-difluorocyclobutyl)methanesulfonamide (PubChem CID 130920053) has the molecular formula C5H9F2NO2S and a molecular weight of 185.19 g/mol. Its IUPAC name is (3,3-difluorocyclobutyl)methanesulfonamide.

Molecular Properties

Compound Name(3,3-difluorocyclobutyl)methanesulfonamide
PubChem CID130920053
Molecular FormulaC5H9F2NO2S
Molecular Weight185.19 g/mol
Exact Mass185.03
IUPAC Name(3,3-difluorocyclobutyl)methanesulfonamide
SMILESNS(=O)(=O)CC1CC(F)(F)C1
InChIInChI=1S/C5H9F2NO2S/c6-5(7)1-4(2-5)3-11(8,9)10/h4H,1-3H2,(H2,8,9,10)
InChIKeyZSRXSEVVBUGDJA-UHFFFAOYSA-N
XLogP0.32
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.19
LogP ≤ 50.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Cyclobutanemethanesulfonamide
CID 22485631
(3,3-Difluorocyclobutyl)methanesulfonyl chloride
CID 90355675
3-Methylcyclobutane-1-sulfonamide
CID 103564838
3-(Difluoromethyl)cyclobutane-1-sulfonyl chloride
CID 118868806
3-(Trifluoromethyl)cyclobutane-1-sulfonyl chloride
CID 131196495
[3-(Trifluoromethyl)cyclobutyl]methanesulfonyl chloride
CID 138987509
2-(2,2-Difluorocyclopropyl)ethane-1-sulfonamide
CID 145913829
1,1,1-Trifluoro-3-methylbutane-2-sulfonamide
CID 88084017
(3-Fluorocyclobutyl)methanesulfonamide
CID 126717840
3,3-Difluoro-2-methylpropane-1-sulfonamide
CID 126718378
3,3,3-Trifluoro-2-methylpropane-1-sulfonamide
CID 126718385
(2,2-Difluorocyclobutyl)methanesulfonyl chloride
CID 131433079

Frequently Asked Questions

What is the IUPAC name of (3,3-difluorocyclobutyl)methanesulfonamide?
The IUPAC name of (3,3-difluorocyclobutyl)methanesulfonamide (CID 130920053) is (3,3-difluorocyclobutyl)methanesulfonamide.
What is the SMILES notation for (3,3-difluorocyclobutyl)methanesulfonamide?
The canonical SMILES for (3,3-difluorocyclobutyl)methanesulfonamide is NS(=O)(=O)CC1CC(F)(F)C1.
What is the InChIKey of (3,3-difluorocyclobutyl)methanesulfonamide?
The InChIKey is ZSRXSEVVBUGDJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9F2NO2S/c6-5(7)1-4(2-5)3-11(8,9)10/h4H,1-3H2,(H2,8,9,10).
What are the key properties of (3,3-difluorocyclobutyl)methanesulfonamide?
(3,3-difluorocyclobutyl)methanesulfonamide has a molecular weight of 185.19 g/mol, XLogP of 0.32, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3,3-difluorocyclobutyl)methanesulfonamide is sourced from PubChem (CID 130920053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).