2-amino-N-cyclopropylethanesulfonamide

C5H12N2O2S — CID 16787497

IUPAC2-amino-N-cyclopropylethanesulfonamide
SMILESNCCS(=O)(=O)NC1CC1
InChIInChI=1S/C5H12N2O2S/c6-3-4-10(8,9)7-5-1-2-5/h5,7H,1-4,6H2
InChIKeyOCBRNYFPRWGYMS-UHFFFAOYSA-N
MW164.23 g/mol
LogP-0.97
Rot. Bonds4

About 2-amino-N-cyclopropylethanesulfonamide

2-amino-N-cyclopropylethanesulfonamide (PubChem CID 16787497) has the molecular formula C5H12N2O2S and a molecular weight of 164.23 g/mol. Its IUPAC name is 2-amino-N-cyclopropylethanesulfonamide.

Molecular Properties

Compound Name2-amino-N-cyclopropylethanesulfonamide
PubChem CID16787497
Molecular FormulaC5H12N2O2S
Molecular Weight164.23 g/mol
Exact Mass164.06
IUPAC Name2-amino-N-cyclopropylethanesulfonamide
SMILESNCCS(=O)(=O)NC1CC1
InChIInChI=1S/C5H12N2O2S/c6-3-4-10(8,9)7-5-1-2-5/h5,7H,1-4,6H2
InChIKeyOCBRNYFPRWGYMS-UHFFFAOYSA-N
XLogP-0.97
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.23
LogP ≤ 5-0.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-cyclopropylethanesulfonamide?
The IUPAC name of 2-amino-N-cyclopropylethanesulfonamide (CID 16787497) is 2-amino-N-cyclopropylethanesulfonamide.
What is the SMILES notation for 2-amino-N-cyclopropylethanesulfonamide?
The canonical SMILES for 2-amino-N-cyclopropylethanesulfonamide is NCCS(=O)(=O)NC1CC1.
What is the InChIKey of 2-amino-N-cyclopropylethanesulfonamide?
The InChIKey is OCBRNYFPRWGYMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2O2S/c6-3-4-10(8,9)7-5-1-2-5/h5,7H,1-4,6H2.
What are the key properties of 2-amino-N-cyclopropylethanesulfonamide?
2-amino-N-cyclopropylethanesulfonamide has a molecular weight of 164.23 g/mol, XLogP of -0.97, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-cyclopropylethanesulfonamide is sourced from PubChem (CID 16787497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).