3-[2-[cyclopropyl(sulfamoyl)amino]ethyl]azetidine

C8H17N3O2S — CID 163275416

IUPAC3-[2-[cyclopropyl(sulfamoyl)amino]ethyl]azetidine
SMILESNS(=O)(=O)N(CCC1CNC1)C1CC1
InChIInChI=1S/C8H17N3O2S/c9-14(12,13)11(8-1-2-8)4-3-7-5-10-6-7/h7-8,10H,1-6H2,(H2,9,12,13)
InChIKeyVGIPFMONUMDBID-UHFFFAOYSA-N
MW219.31 g/mol
LogP-0.74
Rot. Bonds5

About 3-[2-[cyclopropyl(sulfamoyl)amino]ethyl]azetidine

3-[2-[cyclopropyl(sulfamoyl)amino]ethyl]azetidine (PubChem CID 163275416) has the molecular formula C8H17N3O2S and a molecular weight of 219.31 g/mol. Its IUPAC name is 3-[2-[cyclopropyl(sulfamoyl)amino]ethyl]azetidine.

Molecular Properties

Compound Name3-[2-[cyclopropyl(sulfamoyl)amino]ethyl]azetidine
PubChem CID163275416
Molecular FormulaC8H17N3O2S
Molecular Weight219.31 g/mol
Exact Mass219.10
IUPAC Name3-[2-[cyclopropyl(sulfamoyl)amino]ethyl]azetidine
SMILESNS(=O)(=O)N(CCC1CNC1)C1CC1
InChIInChI=1S/C8H17N3O2S/c9-14(12,13)11(8-1-2-8)4-3-7-5-10-6-7/h7-8,10H,1-6H2,(H2,9,12,13)
InChIKeyVGIPFMONUMDBID-UHFFFAOYSA-N
XLogP-0.74
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.31
LogP ≤ 5-0.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[2-[cyclopropyl(sulfamoyl)amino]ethyl]azetidine?
The IUPAC name of 3-[2-[cyclopropyl(sulfamoyl)amino]ethyl]azetidine (CID 163275416) is 3-[2-[cyclopropyl(sulfamoyl)amino]ethyl]azetidine.
What is the SMILES notation for 3-[2-[cyclopropyl(sulfamoyl)amino]ethyl]azetidine?
The canonical SMILES for 3-[2-[cyclopropyl(sulfamoyl)amino]ethyl]azetidine is NS(=O)(=O)N(CCC1CNC1)C1CC1.
What is the InChIKey of 3-[2-[cyclopropyl(sulfamoyl)amino]ethyl]azetidine?
The InChIKey is VGIPFMONUMDBID-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3O2S/c9-14(12,13)11(8-1-2-8)4-3-7-5-10-6-7/h7-8,10H,1-6H2,(H2,9,12,13).
What are the key properties of 3-[2-[cyclopropyl(sulfamoyl)amino]ethyl]azetidine?
3-[2-[cyclopropyl(sulfamoyl)amino]ethyl]azetidine has a molecular weight of 219.31 g/mol, XLogP of -0.74, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-[cyclopropyl(sulfamoyl)amino]ethyl]azetidine is sourced from PubChem (CID 163275416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).