N-butyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)methanesulfonamide

C11H22N2O3S — CID 113148243

IUPACN-butyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)methanesulfonamide
SMILESCCCCN(CC(=O)N1CCCC1)S(C)(=O)=O
InChIInChI=1S/C11H22N2O3S/c1-3-4-9-13(17(2,15)16)10-11(14)12-7-5-6-8-12/h3-10H2,1-2H3
InChIKeyBZAKONGLOZZNGH-UHFFFAOYSA-N
MW262.37 g/mol
LogP0.67
Rot. Bonds6

About N-butyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)methanesulfonamide

N-butyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)methanesulfonamide (PubChem CID 113148243) has the molecular formula C11H22N2O3S and a molecular weight of 262.37 g/mol. Its IUPAC name is N-butyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)methanesulfonamide.

Molecular Properties

Compound NameN-butyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)methanesulfonamide
PubChem CID113148243
Molecular FormulaC11H22N2O3S
Molecular Weight262.37 g/mol
Exact Mass262.14
IUPAC NameN-butyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)methanesulfonamide
SMILESCCCCN(CC(=O)N1CCCC1)S(C)(=O)=O
InChIInChI=1S/C11H22N2O3S/c1-3-4-9-13(17(2,15)16)10-11(14)12-7-5-6-8-12/h3-10H2,1-2H3
InChIKeyBZAKONGLOZZNGH-UHFFFAOYSA-N
XLogP0.67
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.37
LogP ≤ 50.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-oxo-2-pyrrolidin-1-ylethyl)-N-propylmethanesulfonamide
CID 113147458
N-[3-(dimethylamino)propyl]-N-(2-oxo-2-piperidin-1-ylethyl)methanesulfonamide
CID 113150088
N-[2-(azepan-1-yl)-2-oxoethyl]-N-(3-methylbutyl)methanesulfonamide
CID 113153265
1-(azepan-1-yl)-2-[butyl(ethyl)amino]ethanone
CID 86910796
N-[2-(4-chlorophenyl)ethyl]-N-(2-oxo-2-piperidin-1-ylethyl)methanesulfonamide
CID 113152545
2-[2-aminoethyl(butyl)amino]-1-piperidin-1-ylethanone
CID 63761864
ethyl 4-[3-[butyl(methylsulfonyl)amino]propanoyl]piperazine-1-carboxylate
CID 113136690
N-(2-oxo-2-pyrrolidin-1-ylethyl)-N-propan-2-ylmethanesulfonamide
CID 113147650
N-(2-oxo-2-pyrrolidin-1-ylethyl)-N-pentylacetamide
CID 113166654
N-(3-oxo-3-piperidin-1-ylpropyl)-N-prop-2-enylmethanesulfonamide
CID 113136448
N-(3-methoxypropyl)-N-(3-oxo-3-pyrrolidin-1-ylpropyl)methanesulfonamide
CID 113137802
1-pyrrolidin-1-ylheptadecan-1-one
CID 574649

Frequently Asked Questions

What is the IUPAC name of N-butyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)methanesulfonamide?
The IUPAC name of N-butyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)methanesulfonamide (CID 113148243) is N-butyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)methanesulfonamide.
What is the SMILES notation for N-butyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)methanesulfonamide?
The canonical SMILES for N-butyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)methanesulfonamide is CCCCN(CC(=O)N1CCCC1)S(C)(=O)=O.
What is the InChIKey of N-butyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)methanesulfonamide?
The InChIKey is BZAKONGLOZZNGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3S/c1-3-4-9-13(17(2,15)16)10-11(14)12-7-5-6-8-12/h3-10H2,1-2H3.
What are the key properties of N-butyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)methanesulfonamide?
N-butyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)methanesulfonamide has a molecular weight of 262.37 g/mol, XLogP of 0.67, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)methanesulfonamide is sourced from PubChem (CID 113148243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).