2-(methylamino)-N-sulfamoylacetamide

C3H9N3O3S — CID 59215749

IUPAC2-(methylamino)-N-sulfamoylacetamide
SMILESCNCC(=O)NS(N)(=O)=O
InChIInChI=1S/C3H9N3O3S/c1-5-2-3(7)6-10(4,8)9/h5H,2H2,1H3,(H,6,7)(H2,4,8,9)
InChIKeyIISCPVNZTWOMKX-UHFFFAOYSA-N
MW167.19 g/mol
LogP-2.47
Rot. Bonds3

About 2-(methylamino)-N-sulfamoylacetamide

2-(methylamino)-N-sulfamoylacetamide (PubChem CID 59215749) has the molecular formula C3H9N3O3S and a molecular weight of 167.19 g/mol. Its IUPAC name is 2-(methylamino)-N-sulfamoylacetamide.

Molecular Properties

Compound Name2-(methylamino)-N-sulfamoylacetamide
PubChem CID59215749
Molecular FormulaC3H9N3O3S
Molecular Weight167.19 g/mol
Exact Mass167.04
IUPAC Name2-(methylamino)-N-sulfamoylacetamide
SMILESCNCC(=O)NS(N)(=O)=O
InChIInChI=1S/C3H9N3O3S/c1-5-2-3(7)6-10(4,8)9/h5H,2H2,1H3,(H,6,7)(H2,4,8,9)
InChIKeyIISCPVNZTWOMKX-UHFFFAOYSA-N
XLogP-2.47
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.19
LogP ≤ 5-2.47
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-sulfamoylacetamide?
The IUPAC name of 2-(methylamino)-N-sulfamoylacetamide (CID 59215749) is 2-(methylamino)-N-sulfamoylacetamide.
What is the SMILES notation for 2-(methylamino)-N-sulfamoylacetamide?
The canonical SMILES for 2-(methylamino)-N-sulfamoylacetamide is CNCC(=O)NS(N)(=O)=O.
What is the InChIKey of 2-(methylamino)-N-sulfamoylacetamide?
The InChIKey is IISCPVNZTWOMKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H9N3O3S/c1-5-2-3(7)6-10(4,8)9/h5H,2H2,1H3,(H,6,7)(H2,4,8,9).
What are the key properties of 2-(methylamino)-N-sulfamoylacetamide?
2-(methylamino)-N-sulfamoylacetamide has a molecular weight of 167.19 g/mol, XLogP of -2.47, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-sulfamoylacetamide is sourced from PubChem (CID 59215749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).