N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)ethanesulfonamide

C11H22N2O2S — CID 106608788

IUPACN-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)ethanesulfonamide
SMILESCCS(=O)(=O)N(CC1CC1)CC1CCCN1
InChIInChI=1S/C11H22N2O2S/c1-2-16(14,15)13(8-10-5-6-10)9-11-4-3-7-12-11/h10-12H,2-9H2,1H3
InChIKeyAGLIGDQGADQRIB-UHFFFAOYSA-N
MW246.38 g/mol
LogP0.80
Rot. Bonds6

About N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)ethanesulfonamide

N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)ethanesulfonamide (PubChem CID 106608788) has the molecular formula C11H22N2O2S and a molecular weight of 246.38 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)ethanesulfonamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)ethanesulfonamide
PubChem CID106608788
Molecular FormulaC11H22N2O2S
Molecular Weight246.38 g/mol
Exact Mass246.14
IUPAC NameN-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)ethanesulfonamide
SMILESCCS(=O)(=O)N(CC1CC1)CC1CCCN1
InChIInChI=1S/C11H22N2O2S/c1-2-16(14,15)13(8-10-5-6-10)9-11-4-3-7-12-11/h10-12H,2-9H2,1H3
InChIKeyAGLIGDQGADQRIB-UHFFFAOYSA-N
XLogP0.80
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.38
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)ethanesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[[cyclopropylmethyl(propylsulfamoyl)amino]methyl]pyrrolidine
CID 106608854
ethyl 2-[cyclopropylmethyl(pyrrolidin-2-ylmethyl)sulfamoyl]acetate
CID 106608776
1-methylsulfonyl-N-propyl-N-(pyrrolidin-2-ylmethyl)methanesulfonamide
CID 106608529
N-(cyclopropylmethyl)-4-methyl-N-(pyrrolidin-2-ylmethyl)piperidine-1-sulfonamide
CID 106608896
N-butyl-1-cyclohexyl-N-(pyrrolidin-2-ylmethyl)methanesulfonamide
CID 106609116
N-ethyl-2-methyl-N-(pyrrolidin-2-ylmethyl)propane-1-sulfonamide
CID 106608119
N-(cyclopropylmethyl)-2-methyl-N-(pyrrolidin-2-ylmethyl)piperidine-1-sulfonamide
CID 106608661
N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)benzenesulfonamide
CID 106608787
N-(cyclopropylmethyl)-2-methyl-N-(pyrrolidin-2-ylmethyl)benzenesulfonamide
CID 106608711
1-cyano-N-ethyl-N-(pyrrolidin-2-ylmethyl)methanesulfonamide
CID 106607994
N-butyl-N-(pyrrolidin-2-ylmethyl)prop-2-ene-1-sulfonamide
CID 106609362
N,N-diethyl-2-pyrrolidin-2-ylethanesulfonamide
CID 115040519

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)ethanesulfonamide?
The IUPAC name of N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)ethanesulfonamide (CID 106608788) is N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)ethanesulfonamide.
What is the SMILES notation for N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)ethanesulfonamide?
The canonical SMILES for N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)ethanesulfonamide is CCS(=O)(=O)N(CC1CC1)CC1CCCN1.
What is the InChIKey of N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)ethanesulfonamide?
The InChIKey is AGLIGDQGADQRIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2S/c1-2-16(14,15)13(8-10-5-6-10)9-11-4-3-7-12-11/h10-12H,2-9H2,1H3.
What are the key properties of N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)ethanesulfonamide?
N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)ethanesulfonamide has a molecular weight of 246.38 g/mol, XLogP of 0.80, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-N-(pyrrolidin-2-ylmethyl)ethanesulfonamide is sourced from PubChem (CID 106608788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).