1-[2-[methyl(sulfamoyl)amino]acetyl]azetidine-3-carboxamide

C7H14N4O4S — CID 162460121

IUPAC1-[2-[methyl(sulfamoyl)amino]acetyl]azetidine-3-carboxamide
SMILESCN(CC(=O)N1CC(C(N)=O)C1)S(N)(=O)=O
InChIInChI=1S/C7H14N4O4S/c1-10(16(9,14)15)4-6(12)11-2-5(3-11)7(8)13/h5H,2-4H2,1H3,(H2,8,13)(H2,9,14,15)
InChIKeyDPRFOMWCSICXQO-UHFFFAOYSA-N
MW250.28 g/mol
LogP-2.93
Rot. Bonds4

About 1-[2-[methyl(sulfamoyl)amino]acetyl]azetidine-3-carboxamide

1-[2-[methyl(sulfamoyl)amino]acetyl]azetidine-3-carboxamide (PubChem CID 162460121) has the molecular formula C7H14N4O4S and a molecular weight of 250.28 g/mol. Its IUPAC name is 1-[2-[methyl(sulfamoyl)amino]acetyl]azetidine-3-carboxamide.

Molecular Properties

Compound Name1-[2-[methyl(sulfamoyl)amino]acetyl]azetidine-3-carboxamide
PubChem CID162460121
Molecular FormulaC7H14N4O4S
Molecular Weight250.28 g/mol
Exact Mass250.07
IUPAC Name1-[2-[methyl(sulfamoyl)amino]acetyl]azetidine-3-carboxamide
SMILESCN(CC(=O)N1CC(C(N)=O)C1)S(N)(=O)=O
InChIInChI=1S/C7H14N4O4S/c1-10(16(9,14)15)4-6(12)11-2-5(3-11)7(8)13/h5H,2-4H2,1H3,(H2,8,13)(H2,9,14,15)
InChIKeyDPRFOMWCSICXQO-UHFFFAOYSA-N
XLogP-2.93
TPSA126.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.28
LogP ≤ 5-2.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[2-[methyl(sulfamoyl)amino]acetyl]azetidine-3-carboxamide?
The IUPAC name of 1-[2-[methyl(sulfamoyl)amino]acetyl]azetidine-3-carboxamide (CID 162460121) is 1-[2-[methyl(sulfamoyl)amino]acetyl]azetidine-3-carboxamide.
What is the SMILES notation for 1-[2-[methyl(sulfamoyl)amino]acetyl]azetidine-3-carboxamide?
The canonical SMILES for 1-[2-[methyl(sulfamoyl)amino]acetyl]azetidine-3-carboxamide is CN(CC(=O)N1CC(C(N)=O)C1)S(N)(=O)=O.
What is the InChIKey of 1-[2-[methyl(sulfamoyl)amino]acetyl]azetidine-3-carboxamide?
The InChIKey is DPRFOMWCSICXQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N4O4S/c1-10(16(9,14)15)4-6(12)11-2-5(3-11)7(8)13/h5H,2-4H2,1H3,(H2,8,13)(H2,9,14,15).
What are the key properties of 1-[2-[methyl(sulfamoyl)amino]acetyl]azetidine-3-carboxamide?
1-[2-[methyl(sulfamoyl)amino]acetyl]azetidine-3-carboxamide has a molecular weight of 250.28 g/mol, XLogP of -2.93, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[methyl(sulfamoyl)amino]acetyl]azetidine-3-carboxamide is sourced from PubChem (CID 162460121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).