2-[(1-propan-2-ylazetidin-3-yl)sulfamoyl]acetamide

C8H17N3O3S — CID 68821889

IUPAC2-[(1-propan-2-ylazetidin-3-yl)sulfamoyl]acetamide
SMILESCC(C)N1CC(NS(=O)(=O)CC(N)=O)C1
InChIInChI=1S/C8H17N3O3S/c1-6(2)11-3-7(4-11)10-15(13,14)5-8(9)12/h6-7,10H,3-5H2,1-2H3,(H2,9,12)
InChIKeySKDUPXHGBWKJGM-UHFFFAOYSA-N
MW235.31 g/mol
LogP-1.52
Rot. Bonds5

About 2-[(1-propan-2-ylazetidin-3-yl)sulfamoyl]acetamide

2-[(1-propan-2-ylazetidin-3-yl)sulfamoyl]acetamide (PubChem CID 68821889) has the molecular formula C8H17N3O3S and a molecular weight of 235.31 g/mol. Its IUPAC name is 2-[(1-propan-2-ylazetidin-3-yl)sulfamoyl]acetamide.

Molecular Properties

Compound Name2-[(1-propan-2-ylazetidin-3-yl)sulfamoyl]acetamide
PubChem CID68821889
Molecular FormulaC8H17N3O3S
Molecular Weight235.31 g/mol
Exact Mass235.10
IUPAC Name2-[(1-propan-2-ylazetidin-3-yl)sulfamoyl]acetamide
SMILESCC(C)N1CC(NS(=O)(=O)CC(N)=O)C1
InChIInChI=1S/C8H17N3O3S/c1-6(2)11-3-7(4-11)10-15(13,14)5-8(9)12/h6-7,10H,3-5H2,1-2H3,(H2,9,12)
InChIKeySKDUPXHGBWKJGM-UHFFFAOYSA-N
XLogP-1.52
TPSA92.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.31
LogP ≤ 5-1.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(1-propan-2-ylazetidin-3-yl)sulfamoyl]acetamide?
The IUPAC name of 2-[(1-propan-2-ylazetidin-3-yl)sulfamoyl]acetamide (CID 68821889) is 2-[(1-propan-2-ylazetidin-3-yl)sulfamoyl]acetamide.
What is the SMILES notation for 2-[(1-propan-2-ylazetidin-3-yl)sulfamoyl]acetamide?
The canonical SMILES for 2-[(1-propan-2-ylazetidin-3-yl)sulfamoyl]acetamide is CC(C)N1CC(NS(=O)(=O)CC(N)=O)C1.
What is the InChIKey of 2-[(1-propan-2-ylazetidin-3-yl)sulfamoyl]acetamide?
The InChIKey is SKDUPXHGBWKJGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3O3S/c1-6(2)11-3-7(4-11)10-15(13,14)5-8(9)12/h6-7,10H,3-5H2,1-2H3,(H2,9,12).
What are the key properties of 2-[(1-propan-2-ylazetidin-3-yl)sulfamoyl]acetamide?
2-[(1-propan-2-ylazetidin-3-yl)sulfamoyl]acetamide has a molecular weight of 235.31 g/mol, XLogP of -1.52, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-propan-2-ylazetidin-3-yl)sulfamoyl]acetamide is sourced from PubChem (CID 68821889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).