N-(1-ethylpyrrolidin-3-yl)methanesulfonamide

C7H16N2O2S — CID 131150504

IUPACN-(1-ethylpyrrolidin-3-yl)methanesulfonamide
SMILESCCN1CCC(NS(C)(=O)=O)C1
InChIInChI=1S/C7H16N2O2S/c1-3-9-5-4-7(6-9)8-12(2,10)11/h7-8H,3-6H2,1-2H3
InChIKeyLNMBLNZZFDHASJ-UHFFFAOYSA-N
MW192.28 g/mol
LogP-0.37
Rot. Bonds3

About N-(1-ethylpyrrolidin-3-yl)methanesulfonamide

N-(1-ethylpyrrolidin-3-yl)methanesulfonamide (PubChem CID 131150504) has the molecular formula C7H16N2O2S and a molecular weight of 192.28 g/mol. Its IUPAC name is N-(1-ethylpyrrolidin-3-yl)methanesulfonamide.

Molecular Properties

Compound NameN-(1-ethylpyrrolidin-3-yl)methanesulfonamide
PubChem CID131150504
Molecular FormulaC7H16N2O2S
Molecular Weight192.28 g/mol
Exact Mass192.09
IUPAC NameN-(1-ethylpyrrolidin-3-yl)methanesulfonamide
SMILESCCN1CCC(NS(C)(=O)=O)C1
InChIInChI=1S/C7H16N2O2S/c1-3-9-5-4-7(6-9)8-12(2,10)11/h7-8H,3-6H2,1-2H3
InChIKeyLNMBLNZZFDHASJ-UHFFFAOYSA-N
XLogP-0.37
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.28
LogP ≤ 5-0.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-ethylpyrrolidin-3-yl)methanesulfonamide?
The IUPAC name of N-(1-ethylpyrrolidin-3-yl)methanesulfonamide (CID 131150504) is N-(1-ethylpyrrolidin-3-yl)methanesulfonamide.
What is the SMILES notation for N-(1-ethylpyrrolidin-3-yl)methanesulfonamide?
The canonical SMILES for N-(1-ethylpyrrolidin-3-yl)methanesulfonamide is CCN1CCC(NS(C)(=O)=O)C1.
What is the InChIKey of N-(1-ethylpyrrolidin-3-yl)methanesulfonamide?
The InChIKey is LNMBLNZZFDHASJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O2S/c1-3-9-5-4-7(6-9)8-12(2,10)11/h7-8H,3-6H2,1-2H3.
What are the key properties of N-(1-ethylpyrrolidin-3-yl)methanesulfonamide?
N-(1-ethylpyrrolidin-3-yl)methanesulfonamide has a molecular weight of 192.28 g/mol, XLogP of -0.37, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylpyrrolidin-3-yl)methanesulfonamide is sourced from PubChem (CID 131150504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).