(2,2-difluoro-1-methylcyclopropyl)methanesulfonamide

C5H9F2NO2S — CID 155982297

IUPAC(2,2-difluoro-1-methylcyclopropyl)methanesulfonamide
SMILESCC1(CS(N)(=O)=O)CC1(F)F
InChIInChI=1S/C5H9F2NO2S/c1-4(2-5(4,6)7)3-11(8,9)10/h2-3H2,1H3,(H2,8,9,10)
InChIKeyYILPVISTFWYGTI-UHFFFAOYSA-N
MW185.19 g/mol
LogP0.32
Rot. Bonds2

About (2,2-difluoro-1-methylcyclopropyl)methanesulfonamide

(2,2-difluoro-1-methylcyclopropyl)methanesulfonamide (PubChem CID 155982297) has the molecular formula C5H9F2NO2S and a molecular weight of 185.19 g/mol. Its IUPAC name is (2,2-difluoro-1-methylcyclopropyl)methanesulfonamide.

Molecular Properties

Compound Name(2,2-difluoro-1-methylcyclopropyl)methanesulfonamide
PubChem CID155982297
Molecular FormulaC5H9F2NO2S
Molecular Weight185.19 g/mol
Exact Mass185.03
IUPAC Name(2,2-difluoro-1-methylcyclopropyl)methanesulfonamide
SMILESCC1(CS(N)(=O)=O)CC1(F)F
InChIInChI=1S/C5H9F2NO2S/c1-4(2-5(4,6)7)3-11(8,9)10/h2-3H2,1H3,(H2,8,9,10)
InChIKeyYILPVISTFWYGTI-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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Frequently Asked Questions

What is the IUPAC name of (2,2-difluoro-1-methylcyclopropyl)methanesulfonamide?
The IUPAC name of (2,2-difluoro-1-methylcyclopropyl)methanesulfonamide (CID 155982297) is (2,2-difluoro-1-methylcyclopropyl)methanesulfonamide.
What is the SMILES notation for (2,2-difluoro-1-methylcyclopropyl)methanesulfonamide?
The canonical SMILES for (2,2-difluoro-1-methylcyclopropyl)methanesulfonamide is CC1(CS(N)(=O)=O)CC1(F)F.
What is the InChIKey of (2,2-difluoro-1-methylcyclopropyl)methanesulfonamide?
The InChIKey is YILPVISTFWYGTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9F2NO2S/c1-4(2-5(4,6)7)3-11(8,9)10/h2-3H2,1H3,(H2,8,9,10).
What are the key properties of (2,2-difluoro-1-methylcyclopropyl)methanesulfonamide?
(2,2-difluoro-1-methylcyclopropyl)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 (2,2-difluoro-1-methylcyclopropyl)methanesulfonamide is sourced from PubChem (CID 155982297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).