N-(1-acetylazetidin-3-yl)methanesulfonamide

C6H12N2O3S — CID 118370545

IUPACN-(1-acetylazetidin-3-yl)methanesulfonamide
SMILESCC(=O)N1CC(NS(C)(=O)=O)C1
InChIInChI=1S/C6H12N2O3S/c1-5(9)8-3-6(4-8)7-12(2,10)11/h6-7H,3-4H2,1-2H3
InChIKeyDXFIEPBRYURQAM-UHFFFAOYSA-N
MW192.24 g/mol
LogP-1.23
Rot. Bonds2

About N-(1-acetylazetidin-3-yl)methanesulfonamide

N-(1-acetylazetidin-3-yl)methanesulfonamide (PubChem CID 118370545) has the molecular formula C6H12N2O3S and a molecular weight of 192.24 g/mol. Its IUPAC name is N-(1-acetylazetidin-3-yl)methanesulfonamide.

Molecular Properties

Compound NameN-(1-acetylazetidin-3-yl)methanesulfonamide
PubChem CID118370545
Molecular FormulaC6H12N2O3S
Molecular Weight192.24 g/mol
Exact Mass192.06
IUPAC NameN-(1-acetylazetidin-3-yl)methanesulfonamide
SMILESCC(=O)N1CC(NS(C)(=O)=O)C1
InChIInChI=1S/C6H12N2O3S/c1-5(9)8-3-6(4-8)7-12(2,10)11/h6-7H,3-4H2,1-2H3
InChIKeyDXFIEPBRYURQAM-UHFFFAOYSA-N
XLogP-1.23
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.24
LogP ≤ 5-1.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1,1,1-trifluoro-N-(1-propanoylazetidin-3-yl)methanesulfonamide
CID 68220936
N-[1-(trifluoromethylsulfonyl)azetidin-3-yl]acetamide
CID 117710540
N-[1-(2,2,2-trifluoroacetyl)azetidin-3-yl]methanesulfonamide
CID 160247720
N-[(1-acetylazetidin-3-yl)methyl]methanesulfonamide
CID 59268329
2-(methanesulfonamido)-N-propan-2-ylacetamide
CID 60682992
2-[(1-Propan-2-ylazetidin-3-yl)sulfamoyl]acetamide
CID 68821889
2-methyl-N-(1-methylsulfonylazetidin-3-yl)propanamide
CID 70852288
2-(methanesulfonamido)-N-methyl-N-propan-2-ylacetamide
CID 87729368
N-[2-(methanesulfonamido)ethyl]-N-methylacetamide
CID 88037117
N-[1-(dimethylsulfamoyl)azetidin-3-yl]acetamide
CID 117710532
N-(1-methylsulfonylazetidin-3-yl)acetamide
CID 117710538
N-(1-sulfamoylazetidin-3-yl)acetamide
CID 117710557

Frequently Asked Questions

What is the IUPAC name of N-(1-acetylazetidin-3-yl)methanesulfonamide?
The IUPAC name of N-(1-acetylazetidin-3-yl)methanesulfonamide (CID 118370545) is N-(1-acetylazetidin-3-yl)methanesulfonamide.
What is the SMILES notation for N-(1-acetylazetidin-3-yl)methanesulfonamide?
The canonical SMILES for N-(1-acetylazetidin-3-yl)methanesulfonamide is CC(=O)N1CC(NS(C)(=O)=O)C1.
What is the InChIKey of N-(1-acetylazetidin-3-yl)methanesulfonamide?
The InChIKey is DXFIEPBRYURQAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O3S/c1-5(9)8-3-6(4-8)7-12(2,10)11/h6-7H,3-4H2,1-2H3.
What are the key properties of N-(1-acetylazetidin-3-yl)methanesulfonamide?
N-(1-acetylazetidin-3-yl)methanesulfonamide has a molecular weight of 192.24 g/mol, XLogP of -1.23, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-acetylazetidin-3-yl)methanesulfonamide is sourced from PubChem (CID 118370545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).