2-ethyl-N-ethylsulfonylpyrrolidine-2-carboxamide

C9H18N2O3S — CID 103307069

IUPAC2-ethyl-N-ethylsulfonylpyrrolidine-2-carboxamide
SMILESCCC1(C(=O)NS(=O)(=O)CC)CCCN1
InChIInChI=1S/C9H18N2O3S/c1-3-9(6-5-7-10-9)8(12)11-15(13,14)4-2/h10H,3-7H2,1-2H3,(H,11,12)
InChIKeyWLVYZCYAQBPCPX-UHFFFAOYSA-N
MW234.32 g/mol
LogP-0.02
Rot. Bonds4

About 2-ethyl-N-ethylsulfonylpyrrolidine-2-carboxamide

2-ethyl-N-ethylsulfonylpyrrolidine-2-carboxamide (PubChem CID 103307069) has the molecular formula C9H18N2O3S and a molecular weight of 234.32 g/mol. Its IUPAC name is 2-ethyl-N-ethylsulfonylpyrrolidine-2-carboxamide.

Molecular Properties

Compound Name2-ethyl-N-ethylsulfonylpyrrolidine-2-carboxamide
PubChem CID103307069
Molecular FormulaC9H18N2O3S
Molecular Weight234.32 g/mol
Exact Mass234.10
IUPAC Name2-ethyl-N-ethylsulfonylpyrrolidine-2-carboxamide
SMILESCCC1(C(=O)NS(=O)(=O)CC)CCCN1
InChIInChI=1S/C9H18N2O3S/c1-3-9(6-5-7-10-9)8(12)11-15(13,14)4-2/h10H,3-7H2,1-2H3,(H,11,12)
InChIKeyWLVYZCYAQBPCPX-UHFFFAOYSA-N
XLogP-0.02
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.32
LogP ≤ 5-0.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-ethyl-N-propylsulfonylpyrrolidine-2-carboxamide
CID 103307585
2-ethyl-N-propan-2-ylsulfonylpyrrolidine-2-carboxamide
CID 103308078
N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-ethylpyrrolidine-2-carboxamide
CID 114009242
N-[2-(dimethylsulfamoyl)ethyl]-2-ethylpyrrolidine-2-carboxamide
CID 106337546
2-ethyl-N-prop-2-enylpyrrolidine-2-carboxamide
CID 83079812
2-ethyl-N-(4-methoxybutan-2-yl)pyrrolidine-2-carboxamide
CID 83071390
N-(azetidin-3-yl)-2-ethylpyrrolidine-2-carboxamide;hydrochloride
CID 130637882
2-ethyl-N-(2-ethylsulfonylphenyl)pyrrolidine-2-carboxamide
CID 83063260
3-[(2-ethylpyrrolidine-2-carbonyl)amino]-2-methylpropanoic acid
CID 83071374
2-ethyl-N-[3-(methylamino)-3-oxopropyl]pyrrolidine-2-carboxamide
CID 83071991
N-(2,3-dihydroxypropyl)-2-ethylpyrrolidine-2-carboxamide
CID 83072487
2-ethyl-N-[(3-methyloxetan-3-yl)methyl]pyrrolidine-2-carboxamide
CID 83073298

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-ethylsulfonylpyrrolidine-2-carboxamide?
The IUPAC name of 2-ethyl-N-ethylsulfonylpyrrolidine-2-carboxamide (CID 103307069) is 2-ethyl-N-ethylsulfonylpyrrolidine-2-carboxamide.
What is the SMILES notation for 2-ethyl-N-ethylsulfonylpyrrolidine-2-carboxamide?
The canonical SMILES for 2-ethyl-N-ethylsulfonylpyrrolidine-2-carboxamide is CCC1(C(=O)NS(=O)(=O)CC)CCCN1.
What is the InChIKey of 2-ethyl-N-ethylsulfonylpyrrolidine-2-carboxamide?
The InChIKey is WLVYZCYAQBPCPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O3S/c1-3-9(6-5-7-10-9)8(12)11-15(13,14)4-2/h10H,3-7H2,1-2H3,(H,11,12).
What are the key properties of 2-ethyl-N-ethylsulfonylpyrrolidine-2-carboxamide?
2-ethyl-N-ethylsulfonylpyrrolidine-2-carboxamide has a molecular weight of 234.32 g/mol, XLogP of -0.02, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-ethylsulfonylpyrrolidine-2-carboxamide is sourced from PubChem (CID 103307069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).