1-ethenylsulfinylpyrrolidine

C6H11NOS — CID 142525136

IUPAC1-ethenylsulfinylpyrrolidine
SMILESC=CS(=O)N1CCCC1
InChIInChI=1S/C6H11NOS/c1-2-9(8)7-5-3-4-6-7/h2H,1,3-6H2
InChIKeyDHEPMMJFTGFBGC-UHFFFAOYSA-N
MW145.23 g/mol
LogP0.89
Rot. Bonds2

About 1-ethenylsulfinylpyrrolidine

1-ethenylsulfinylpyrrolidine (PubChem CID 142525136) has the molecular formula C6H11NOS and a molecular weight of 145.23 g/mol. Its IUPAC name is 1-ethenylsulfinylpyrrolidine.

Molecular Properties

Compound Name1-ethenylsulfinylpyrrolidine
PubChem CID142525136
Molecular FormulaC6H11NOS
Molecular Weight145.23 g/mol
Exact Mass145.06
IUPAC Name1-ethenylsulfinylpyrrolidine
SMILESC=CS(=O)N1CCCC1
InChIInChI=1S/C6H11NOS/c1-2-9(8)7-5-3-4-6-7/h2H,1,3-6H2
InChIKeyDHEPMMJFTGFBGC-UHFFFAOYSA-N
XLogP0.89
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.23
LogP ≤ 50.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-(Ethenesulfonyl)pyrrolidine
CID 15914515
1-Ethenylsulfinyl-3,3-difluoropyrrolidine
CID 129130908
1-Ethenylsulfonyl-2-fluoropyrrolidine
CID 174671019
1-Propan-2-ylsulfinylpyrrolidine
CID 126646950
1-Propylsulfinylpyrrolidine
CID 130963156
1-Propa-1,2-dienylsulfonylpyrrolidine
CID 139931075
1-Ethenylsulfanylpyrrolidine
CID 141062677
1-Prop-2-enylsulfinylpyrrolidine
CID 102223206
1-Ethylsulfinylpyrrolidine
CID 130762671
Ethenyl-methylidene-pyrrolidin-1-yl-lambda4-sulfane
CID 166115326

Frequently Asked Questions

What is the IUPAC name of 1-ethenylsulfinylpyrrolidine?
The IUPAC name of 1-ethenylsulfinylpyrrolidine (CID 142525136) is 1-ethenylsulfinylpyrrolidine.
What is the SMILES notation for 1-ethenylsulfinylpyrrolidine?
The canonical SMILES for 1-ethenylsulfinylpyrrolidine is C=CS(=O)N1CCCC1.
What is the InChIKey of 1-ethenylsulfinylpyrrolidine?
The InChIKey is DHEPMMJFTGFBGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NOS/c1-2-9(8)7-5-3-4-6-7/h2H,1,3-6H2.
What are the key properties of 1-ethenylsulfinylpyrrolidine?
1-ethenylsulfinylpyrrolidine has a molecular weight of 145.23 g/mol, XLogP of 0.89, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenylsulfinylpyrrolidine is sourced from PubChem (CID 142525136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).