1-(3-sulfamoylpropanoyl)azetidine-3-carboxamide

C7H13N3O4S — CID 162460104

IUPAC1-(3-sulfamoylpropanoyl)azetidine-3-carboxamide
SMILESNC(=O)C1CN(C(=O)CCS(N)(=O)=O)C1
InChIInChI=1S/C7H13N3O4S/c8-7(12)5-3-10(4-5)6(11)1-2-15(9,13)14/h5H,1-4H2,(H2,8,12)(H2,9,13,14)
InChIKeyMZCZSPJLONDAIN-UHFFFAOYSA-N
MW235.26 g/mol
LogP-2.39
Rot. Bonds4

About 1-(3-sulfamoylpropanoyl)azetidine-3-carboxamide

1-(3-sulfamoylpropanoyl)azetidine-3-carboxamide (PubChem CID 162460104) has the molecular formula C7H13N3O4S and a molecular weight of 235.26 g/mol. Its IUPAC name is 1-(3-sulfamoylpropanoyl)azetidine-3-carboxamide.

Molecular Properties

Compound Name1-(3-sulfamoylpropanoyl)azetidine-3-carboxamide
PubChem CID162460104
Molecular FormulaC7H13N3O4S
Molecular Weight235.26 g/mol
Exact Mass235.06
IUPAC Name1-(3-sulfamoylpropanoyl)azetidine-3-carboxamide
SMILESNC(=O)C1CN(C(=O)CCS(N)(=O)=O)C1
InChIInChI=1S/C7H13N3O4S/c8-7(12)5-3-10(4-5)6(11)1-2-15(9,13)14/h5H,1-4H2,(H2,8,12)(H2,9,13,14)
InChIKeyMZCZSPJLONDAIN-UHFFFAOYSA-N
XLogP-2.39
TPSA123.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.26
LogP ≤ 5-2.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(3-sulfamoylpropanoyl)azetidine-3-carboxamide?
The IUPAC name of 1-(3-sulfamoylpropanoyl)azetidine-3-carboxamide (CID 162460104) is 1-(3-sulfamoylpropanoyl)azetidine-3-carboxamide.
What is the SMILES notation for 1-(3-sulfamoylpropanoyl)azetidine-3-carboxamide?
The canonical SMILES for 1-(3-sulfamoylpropanoyl)azetidine-3-carboxamide is NC(=O)C1CN(C(=O)CCS(N)(=O)=O)C1.
What is the InChIKey of 1-(3-sulfamoylpropanoyl)azetidine-3-carboxamide?
The InChIKey is MZCZSPJLONDAIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3O4S/c8-7(12)5-3-10(4-5)6(11)1-2-15(9,13)14/h5H,1-4H2,(H2,8,12)(H2,9,13,14).
What are the key properties of 1-(3-sulfamoylpropanoyl)azetidine-3-carboxamide?
1-(3-sulfamoylpropanoyl)azetidine-3-carboxamide has a molecular weight of 235.26 g/mol, XLogP of -2.39, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-sulfamoylpropanoyl)azetidine-3-carboxamide is sourced from PubChem (CID 162460104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).