1-(2-sulfamoylacetyl)azetidine-3-carboxamide

C6H11N3O4S — CID 162460108

IUPAC1-(2-sulfamoylacetyl)azetidine-3-carboxamide
SMILESNC(=O)C1CN(C(=O)CS(N)(=O)=O)C1
InChIInChI=1S/C6H11N3O4S/c7-6(11)4-1-9(2-4)5(10)3-14(8,12)13/h4H,1-3H2,(H2,7,11)(H2,8,12,13)
InChIKeyVLWNDQGHQKEPPT-UHFFFAOYSA-N
MW221.24 g/mol
LogP-2.78
Rot. Bonds3

About 1-(2-sulfamoylacetyl)azetidine-3-carboxamide

1-(2-sulfamoylacetyl)azetidine-3-carboxamide (PubChem CID 162460108) has the molecular formula C6H11N3O4S and a molecular weight of 221.24 g/mol. Its IUPAC name is 1-(2-sulfamoylacetyl)azetidine-3-carboxamide.

Molecular Properties

Compound Name1-(2-sulfamoylacetyl)azetidine-3-carboxamide
PubChem CID162460108
Molecular FormulaC6H11N3O4S
Molecular Weight221.24 g/mol
Exact Mass221.05
IUPAC Name1-(2-sulfamoylacetyl)azetidine-3-carboxamide
SMILESNC(=O)C1CN(C(=O)CS(N)(=O)=O)C1
InChIInChI=1S/C6H11N3O4S/c7-6(11)4-1-9(2-4)5(10)3-14(8,12)13/h4H,1-3H2,(H2,7,11)(H2,8,12,13)
InChIKeyVLWNDQGHQKEPPT-UHFFFAOYSA-N
XLogP-2.78
TPSA123.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.24
LogP ≤ 5-2.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2-sulfamoylacetyl)azetidine-3-carboxamide?
The IUPAC name of 1-(2-sulfamoylacetyl)azetidine-3-carboxamide (CID 162460108) is 1-(2-sulfamoylacetyl)azetidine-3-carboxamide.
What is the SMILES notation for 1-(2-sulfamoylacetyl)azetidine-3-carboxamide?
The canonical SMILES for 1-(2-sulfamoylacetyl)azetidine-3-carboxamide is NC(=O)C1CN(C(=O)CS(N)(=O)=O)C1.
What is the InChIKey of 1-(2-sulfamoylacetyl)azetidine-3-carboxamide?
The InChIKey is VLWNDQGHQKEPPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3O4S/c7-6(11)4-1-9(2-4)5(10)3-14(8,12)13/h4H,1-3H2,(H2,7,11)(H2,8,12,13).
What are the key properties of 1-(2-sulfamoylacetyl)azetidine-3-carboxamide?
1-(2-sulfamoylacetyl)azetidine-3-carboxamide has a molecular weight of 221.24 g/mol, XLogP of -2.78, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-sulfamoylacetyl)azetidine-3-carboxamide is sourced from PubChem (CID 162460108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).