3-(methanesulfonamido)propanamide

C4H10N2O3S — CID 23023535

IUPAC3-(methanesulfonamido)propanamide
SMILESCS(=O)(=O)NCCC(N)=O
InChIInChI=1S/C4H10N2O3S/c1-10(8,9)6-3-2-4(5)7/h6H,2-3H2,1H3,(H2,5,7)
InChIKeyACMVOAIWYPFNCV-UHFFFAOYSA-N
MW166.20 g/mol
LogP-1.59
Rot. Bonds4

About 3-(methanesulfonamido)propanamide

3-(methanesulfonamido)propanamide (PubChem CID 23023535) has the molecular formula C4H10N2O3S and a molecular weight of 166.20 g/mol. Its IUPAC name is 3-(methanesulfonamido)propanamide.

Molecular Properties

Compound Name3-(methanesulfonamido)propanamide
PubChem CID23023535
Molecular FormulaC4H10N2O3S
Molecular Weight166.20 g/mol
Exact Mass166.04
IUPAC Name3-(methanesulfonamido)propanamide
SMILESCS(=O)(=O)NCCC(N)=O
InChIInChI=1S/C4H10N2O3S/c1-10(8,9)6-3-2-4(5)7/h6H,2-3H2,1H3,(H2,5,7)
InChIKeyACMVOAIWYPFNCV-UHFFFAOYSA-N
XLogP-1.59
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.20
LogP ≤ 5-1.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(methanesulfonamido)propanamide?
The IUPAC name of 3-(methanesulfonamido)propanamide (CID 23023535) is 3-(methanesulfonamido)propanamide.
What is the SMILES notation for 3-(methanesulfonamido)propanamide?
The canonical SMILES for 3-(methanesulfonamido)propanamide is CS(=O)(=O)NCCC(N)=O.
What is the InChIKey of 3-(methanesulfonamido)propanamide?
The InChIKey is ACMVOAIWYPFNCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10N2O3S/c1-10(8,9)6-3-2-4(5)7/h6H,2-3H2,1H3,(H2,5,7).
What are the key properties of 3-(methanesulfonamido)propanamide?
3-(methanesulfonamido)propanamide has a molecular weight of 166.20 g/mol, XLogP of -1.59, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methanesulfonamido)propanamide is sourced from PubChem (CID 23023535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).