N-benzylpyrrolidine-3-sulfonamide

C11H16N2O2S — CID 65420907

IUPACN-benzylpyrrolidine-3-sulfonamide
SMILESO=S(=O)(NCc1ccccc1)C1CCNC1
InChIInChI=1S/C11H16N2O2S/c14-16(15,11-6-7-12-9-11)13-8-10-4-2-1-3-5-10/h1-5,11-13H,6-9H2
InChIKeyDBELDVWLZVMDRK-UHFFFAOYSA-N
MW240.33 g/mol
LogP0.47
Rot. Bonds4

About N-benzylpyrrolidine-3-sulfonamide

N-benzylpyrrolidine-3-sulfonamide (PubChem CID 65420907) has the molecular formula C11H16N2O2S and a molecular weight of 240.33 g/mol. Its IUPAC name is N-benzylpyrrolidine-3-sulfonamide.

Molecular Properties

Compound NameN-benzylpyrrolidine-3-sulfonamide
PubChem CID65420907
Molecular FormulaC11H16N2O2S
Molecular Weight240.33 g/mol
Exact Mass240.09
IUPAC NameN-benzylpyrrolidine-3-sulfonamide
SMILESO=S(=O)(NCc1ccccc1)C1CCNC1
InChIInChI=1S/C11H16N2O2S/c14-16(15,11-6-7-12-9-11)13-8-10-4-2-1-3-5-10/h1-5,11-13H,6-9H2
InChIKeyDBELDVWLZVMDRK-UHFFFAOYSA-N
XLogP0.47
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.33
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-benzylpyrrolidine-3-sulfonamide 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

N-[[4-(trifluoromethyl)phenyl]methyl]pyrrolidine-3-sulfonamide
CID 65418983
N-phenylpyrrolidine-3-sulfonamide
CID 65422205
N-[(2-methoxyphenyl)methyl]pyrrolidine-3-sulfonamide
CID 65422417
(3R)-N-ethylpyrrolidine-3-sulfonamide
CID 96995954
N-benzyl-2-piperidin-4-ylethanesulfonamide
CID 60890567
(3R)-N-benzyl-1,1-dioxothiolane-3-sulfonamide
CID 7068858
N-[(2-methylpyrazol-3-yl)methyl]pyrrolidine-3-sulfonamide
CID 65418761
N-benzyl-1-[(3S)-pyrrolidin-3-yl]methanamine
CID 10726362
N-(furan-2-ylmethyl)piperidine-3-sulfonamide
CID 24690010
N-[(3-chloro-4-fluorophenyl)methyl]piperidine-3-sulfonamide
CID 62532599
N-(2-phenylpropyl)piperidine-3-sulfonamide
CID 104591796
3-(benzylsulfamoyl)pyrrolidine-1-carboxylic acid
CID 69113749

Frequently Asked Questions

What is the IUPAC name of N-benzylpyrrolidine-3-sulfonamide?
The IUPAC name of N-benzylpyrrolidine-3-sulfonamide (CID 65420907) is N-benzylpyrrolidine-3-sulfonamide.
What is the SMILES notation for N-benzylpyrrolidine-3-sulfonamide?
The canonical SMILES for N-benzylpyrrolidine-3-sulfonamide is O=S(=O)(NCc1ccccc1)C1CCNC1.
What is the InChIKey of N-benzylpyrrolidine-3-sulfonamide?
The InChIKey is DBELDVWLZVMDRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2S/c14-16(15,11-6-7-12-9-11)13-8-10-4-2-1-3-5-10/h1-5,11-13H,6-9H2.
What are the key properties of N-benzylpyrrolidine-3-sulfonamide?
N-benzylpyrrolidine-3-sulfonamide has a molecular weight of 240.33 g/mol, XLogP of 0.47, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzylpyrrolidine-3-sulfonamide is sourced from PubChem (CID 65420907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).