N-[2-(dimethylsulfamoyl)ethyl]-2-pyrrolidin-2-ylacetamide

C10H21N3O3S — CID 106337483

IUPACN-[2-(dimethylsulfamoyl)ethyl]-2-pyrrolidin-2-ylacetamide
SMILESCN(C)S(=O)(=O)CCNC(=O)CC1CCCN1
InChIInChI=1S/C10H21N3O3S/c1-13(2)17(15,16)7-6-12-10(14)8-9-4-3-5-11-9/h9,11H,3-8H2,1-2H3,(H,12,14)
InChIKeyZZARJOBTXQNIAN-UHFFFAOYSA-N
MW263.36 g/mol
LogP-0.86
Rot. Bonds6

About N-[2-(dimethylsulfamoyl)ethyl]-2-pyrrolidin-2-ylacetamide

N-[2-(dimethylsulfamoyl)ethyl]-2-pyrrolidin-2-ylacetamide (PubChem CID 106337483) has the molecular formula C10H21N3O3S and a molecular weight of 263.36 g/mol. Its IUPAC name is N-[2-(dimethylsulfamoyl)ethyl]-2-pyrrolidin-2-ylacetamide.

Molecular Properties

Compound NameN-[2-(dimethylsulfamoyl)ethyl]-2-pyrrolidin-2-ylacetamide
PubChem CID106337483
Molecular FormulaC10H21N3O3S
Molecular Weight263.36 g/mol
Exact Mass263.13
IUPAC NameN-[2-(dimethylsulfamoyl)ethyl]-2-pyrrolidin-2-ylacetamide
SMILESCN(C)S(=O)(=O)CCNC(=O)CC1CCCN1
InChIInChI=1S/C10H21N3O3S/c1-13(2)17(15,16)7-6-12-10(14)8-9-4-3-5-11-9/h9,11H,3-8H2,1-2H3,(H,12,14)
InChIKeyZZARJOBTXQNIAN-UHFFFAOYSA-N
XLogP-0.86
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.36
LogP ≤ 5-0.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylsulfamoyl)ethyl]-2-pyrrolidin-2-ylacetamide?
The IUPAC name of N-[2-(dimethylsulfamoyl)ethyl]-2-pyrrolidin-2-ylacetamide (CID 106337483) is N-[2-(dimethylsulfamoyl)ethyl]-2-pyrrolidin-2-ylacetamide.
What is the SMILES notation for N-[2-(dimethylsulfamoyl)ethyl]-2-pyrrolidin-2-ylacetamide?
The canonical SMILES for N-[2-(dimethylsulfamoyl)ethyl]-2-pyrrolidin-2-ylacetamide is CN(C)S(=O)(=O)CCNC(=O)CC1CCCN1.
What is the InChIKey of N-[2-(dimethylsulfamoyl)ethyl]-2-pyrrolidin-2-ylacetamide?
The InChIKey is ZZARJOBTXQNIAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O3S/c1-13(2)17(15,16)7-6-12-10(14)8-9-4-3-5-11-9/h9,11H,3-8H2,1-2H3,(H,12,14).
What are the key properties of N-[2-(dimethylsulfamoyl)ethyl]-2-pyrrolidin-2-ylacetamide?
N-[2-(dimethylsulfamoyl)ethyl]-2-pyrrolidin-2-ylacetamide has a molecular weight of 263.36 g/mol, XLogP of -0.86, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylsulfamoyl)ethyl]-2-pyrrolidin-2-ylacetamide is sourced from PubChem (CID 106337483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).