N-[2-(dimethylsulfamoyl)ethyl]pyrrolidine-2-carboxamide

C9H19N3O3S — CID 106337362

IUPACN-[2-(dimethylsulfamoyl)ethyl]pyrrolidine-2-carboxamide
SMILESCN(C)S(=O)(=O)CCNC(=O)C1CCCN1
InChIInChI=1S/C9H19N3O3S/c1-12(2)16(14,15)7-6-11-9(13)8-4-3-5-10-8/h8,10H,3-7H2,1-2H3,(H,11,13)
InChIKeyCQADJPAOBFADGB-UHFFFAOYSA-N
MW249.34 g/mol
LogP-1.25
Rot. Bonds5

About N-[2-(dimethylsulfamoyl)ethyl]pyrrolidine-2-carboxamide

N-[2-(dimethylsulfamoyl)ethyl]pyrrolidine-2-carboxamide (PubChem CID 106337362) has the molecular formula C9H19N3O3S and a molecular weight of 249.34 g/mol. Its IUPAC name is N-[2-(dimethylsulfamoyl)ethyl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylsulfamoyl)ethyl]pyrrolidine-2-carboxamide
PubChem CID106337362
Molecular FormulaC9H19N3O3S
Molecular Weight249.34 g/mol
Exact Mass249.11
IUPAC NameN-[2-(dimethylsulfamoyl)ethyl]pyrrolidine-2-carboxamide
SMILESCN(C)S(=O)(=O)CCNC(=O)C1CCCN1
InChIInChI=1S/C9H19N3O3S/c1-12(2)16(14,15)7-6-11-9(13)8-4-3-5-10-8/h8,10H,3-7H2,1-2H3,(H,11,13)
InChIKeyCQADJPAOBFADGB-UHFFFAOYSA-N
XLogP-1.25
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.34
LogP ≤ 5-1.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[(2S)-pyrrolidine-2-carbonyl]amino]ethanesulfonic acid
CID 15929426
(2R)-N-[2-(ethylsulfamoyl)ethyl]pyrrolidine-2-carboxamide
CID 103796458
N-[2-(dimethylsulfamoyl)ethyl]-2-pyrrolidin-2-ylacetamide
CID 106337483
(2S)-N-[2-[methyl(propan-2-yl)amino]ethyl]pyrrolidine-2-carboxamide
CID 62639882
N-propylpyrrolidine-2-carboxamide
CID 4984185
3-[[(2S)-pyrrolidine-2-carbonyl]amino]propane-1-sulfonic acid
CID 25008297
(2S)-N-[2-[ethyl(methyl)amino]ethyl]pyrrolidine-2-carboxamide
CID 62641676
N-[2-(dimethylsulfamoyl)ethyl]-3-methylpyrrolidine-2-carboxamide
CID 106337275
(2S)-N-butylpyrrolidine-2-carboxamide
CID 22691332
N-[2-(dimethylcarbamoylamino)ethyl]piperidine-2-carboxamide
CID 83110133
N-[2-[methyl(propan-2-yl)amino]ethyl]piperidine-2-carboxamide
CID 62641689
N-[4-(dimethylamino)-4-oxobutyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119303011

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylsulfamoyl)ethyl]pyrrolidine-2-carboxamide?
The IUPAC name of N-[2-(dimethylsulfamoyl)ethyl]pyrrolidine-2-carboxamide (CID 106337362) is N-[2-(dimethylsulfamoyl)ethyl]pyrrolidine-2-carboxamide.
What is the SMILES notation for N-[2-(dimethylsulfamoyl)ethyl]pyrrolidine-2-carboxamide?
The canonical SMILES for N-[2-(dimethylsulfamoyl)ethyl]pyrrolidine-2-carboxamide is CN(C)S(=O)(=O)CCNC(=O)C1CCCN1.
What is the InChIKey of N-[2-(dimethylsulfamoyl)ethyl]pyrrolidine-2-carboxamide?
The InChIKey is CQADJPAOBFADGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O3S/c1-12(2)16(14,15)7-6-11-9(13)8-4-3-5-10-8/h8,10H,3-7H2,1-2H3,(H,11,13).
What are the key properties of N-[2-(dimethylsulfamoyl)ethyl]pyrrolidine-2-carboxamide?
N-[2-(dimethylsulfamoyl)ethyl]pyrrolidine-2-carboxamide has a molecular weight of 249.34 g/mol, XLogP of -1.25, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylsulfamoyl)ethyl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 106337362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).