cis-(1R,2S)-1-methyl-2-methylsulfonylcyclopropane

C5H10O2S — CID 89002807

IUPACcis-(1R,2S)-1-methyl-2-methylsulfonylcyclopropane
SMILESC[C@@H]1C[C@@H]1S(C)(=O)=O
InChIInChI=1S/C5H10O2S/c1-4-3-5(4)8(2,6)7/h4-5H,3H2,1-2H3/t4-,5+/m1/s1
InChIKeyAOWYGOGOGICNBG-UHNVWZDZSA-N
MW134.20 g/mol
LogP0.44
Rot. Bonds1

About cis-(1R,2S)-1-methyl-2-methylsulfonylcyclopropane

cis-(1R,2S)-1-methyl-2-methylsulfonylcyclopropane (PubChem CID 89002807) has the molecular formula C5H10O2S and a molecular weight of 134.20 g/mol. Its IUPAC name is cis-(1R,2S)-1-methyl-2-methylsulfonylcyclopropane.

Molecular Properties

Compound Namecis-(1R,2S)-1-methyl-2-methylsulfonylcyclopropane
PubChem CID89002807
Molecular FormulaC5H10O2S
Molecular Weight134.20 g/mol
Exact Mass134.04
IUPAC Namecis-(1R,2S)-1-methyl-2-methylsulfonylcyclopropane
SMILESC[C@@H]1C[C@@H]1S(C)(=O)=O
InChIInChI=1S/C5H10O2S/c1-4-3-5(4)8(2,6)7/h4-5H,3H2,1-2H3/t4-,5+/m1/s1
InChIKeyAOWYGOGOGICNBG-UHNVWZDZSA-N
XLogP0.44
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.20
LogP ≤ 50.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-methylcyclopropane-1-sulfonic acid
CID 174740813
azane;2-methylcyclopropane-1-sulfonic acid
CID 174740812
2-methylsulfonylcyclopropane-1-sulfonyl fluoride
CID 139363190
(2R,3S)-2-methyl-3-methylsulfonylazetidine
CID 175984932
N-methyl-2-methylsulfonylcyclopropan-1-amine
CID 129191618
cis-(1R,2S)-2-methylsulfonylcyclopropane-1-carbonitrile
CID 99990540
[(1S,2R)-2-methylcyclopropyl] methanesulfonate
CID 58208879
trans-(1R,2R)-2-methylsulfonylcyclobutan-1-amine;hydrochloride
CID 155978246
N,2-dimethyl-3-methylsulfonylcyclopentan-1-amine
CID 64904895
4-methyl-2-methylsulfonyl-N-propylcyclohexan-1-amine
CID 62784580
(2-methylsulfonylcyclopropyl)benzene
CID 89149052
4-methylsulfonylpyrrolidine-3-carboxylic acid
CID 105446919

Frequently Asked Questions

What is the IUPAC name of cis-(1R,2S)-1-methyl-2-methylsulfonylcyclopropane?
The IUPAC name of cis-(1R,2S)-1-methyl-2-methylsulfonylcyclopropane (CID 89002807) is cis-(1R,2S)-1-methyl-2-methylsulfonylcyclopropane.
What is the SMILES notation for cis-(1R,2S)-1-methyl-2-methylsulfonylcyclopropane?
The canonical SMILES for cis-(1R,2S)-1-methyl-2-methylsulfonylcyclopropane is C[C@@H]1C[C@@H]1S(C)(=O)=O.
What is the InChIKey of cis-(1R,2S)-1-methyl-2-methylsulfonylcyclopropane?
The InChIKey is AOWYGOGOGICNBG-UHNVWZDZSA-N. The full InChI is InChI=1S/C5H10O2S/c1-4-3-5(4)8(2,6)7/h4-5H,3H2,1-2H3/t4-,5+/m1/s1.
What are the key properties of cis-(1R,2S)-1-methyl-2-methylsulfonylcyclopropane?
cis-(1R,2S)-1-methyl-2-methylsulfonylcyclopropane has a molecular weight of 134.20 g/mol, XLogP of 0.44, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,2S)-1-methyl-2-methylsulfonylcyclopropane is sourced from PubChem (CID 89002807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).