1-(amino-dimethyl-oxo-λ6-sulfanyl)pyrrolidine

C6H16N2OS — CID 134485238

IUPAC1-(amino-dimethyl-oxo-λ6-sulfanyl)pyrrolidine
SMILESCS(C)(N)(=O)N1CCCC1
InChIInChI=1S/C6H16N2OS/c1-10(2,7,9)8-5-3-4-6-8/h3-6H2,1-2H3,(H2,7,9)
InChIKeyZPLHLOWFATWIQY-UHFFFAOYSA-N
MW164.27 g/mol
LogP-0.05
Rot. Bonds1

About 1-(amino-dimethyl-oxo-λ6-sulfanyl)pyrrolidine

1-(amino-dimethyl-oxo-λ6-sulfanyl)pyrrolidine (PubChem CID 134485238) has the molecular formula C6H16N2OS and a molecular weight of 164.27 g/mol. Its IUPAC name is 1-(amino-dimethyl-oxo-λ6-sulfanyl)pyrrolidine.

Molecular Properties

Compound Name1-(amino-dimethyl-oxo-λ6-sulfanyl)pyrrolidine
PubChem CID134485238
Molecular FormulaC6H16N2OS
Molecular Weight164.27 g/mol
Exact Mass164.10
IUPAC Name1-(amino-dimethyl-oxo-λ6-sulfanyl)pyrrolidine
SMILESCS(C)(N)(=O)N1CCCC1
InChIInChI=1S/C6H16N2OS/c1-10(2,7,9)8-5-3-4-6-8/h3-6H2,1-2H3,(H2,7,9)
InChIKeyZPLHLOWFATWIQY-UHFFFAOYSA-N
XLogP-0.05
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.27
LogP ≤ 5-0.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(amino-dimethyl-oxo-λ6-sulfanyl)pyrrolidine?
The IUPAC name of 1-(amino-dimethyl-oxo-λ6-sulfanyl)pyrrolidine (CID 134485238) is 1-(amino-dimethyl-oxo-λ6-sulfanyl)pyrrolidine.
What is the SMILES notation for 1-(amino-dimethyl-oxo-λ6-sulfanyl)pyrrolidine?
The canonical SMILES for 1-(amino-dimethyl-oxo-λ6-sulfanyl)pyrrolidine is CS(C)(N)(=O)N1CCCC1.
What is the InChIKey of 1-(amino-dimethyl-oxo-λ6-sulfanyl)pyrrolidine?
The InChIKey is ZPLHLOWFATWIQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H16N2OS/c1-10(2,7,9)8-5-3-4-6-8/h3-6H2,1-2H3,(H2,7,9).
What are the key properties of 1-(amino-dimethyl-oxo-λ6-sulfanyl)pyrrolidine?
1-(amino-dimethyl-oxo-λ6-sulfanyl)pyrrolidine has a molecular weight of 164.27 g/mol, XLogP of -0.05, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(amino-dimethyl-oxo-λ6-sulfanyl)pyrrolidine is sourced from PubChem (CID 134485238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).