N-[4-(sulfamoylmethyl)phenyl]pyrrolidine-1-carboxamide

C12H17N3O3S — CID 79161755

IUPACN-[4-(sulfamoylmethyl)phenyl]pyrrolidine-1-carboxamide
SMILESNS(=O)(=O)Cc1ccc(NC(=O)N2CCCC2)cc1
InChIInChI=1S/C12H17N3O3S/c13-19(17,18)9-10-3-5-11(6-4-10)14-12(16)15-7-1-2-8-15/h3-6H,1-2,7-9H2,(H,14,16)(H2,13,17,18)
InChIKeyMZQDNNYXKDURQQ-UHFFFAOYSA-N
MW283.35 g/mol
LogP1.10
Rot. Bonds3

About N-[4-(sulfamoylmethyl)phenyl]pyrrolidine-1-carboxamide

N-[4-(sulfamoylmethyl)phenyl]pyrrolidine-1-carboxamide (PubChem CID 79161755) has the molecular formula C12H17N3O3S and a molecular weight of 283.35 g/mol. Its IUPAC name is N-[4-(sulfamoylmethyl)phenyl]pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-[4-(sulfamoylmethyl)phenyl]pyrrolidine-1-carboxamide
PubChem CID79161755
Molecular FormulaC12H17N3O3S
Molecular Weight283.35 g/mol
Exact Mass283.10
IUPAC NameN-[4-(sulfamoylmethyl)phenyl]pyrrolidine-1-carboxamide
SMILESNS(=O)(=O)Cc1ccc(NC(=O)N2CCCC2)cc1
InChIInChI=1S/C12H17N3O3S/c13-19(17,18)9-10-3-5-11(6-4-10)14-12(16)15-7-1-2-8-15/h3-6H,1-2,7-9H2,(H,14,16)(H2,13,17,18)
InChIKeyMZQDNNYXKDURQQ-UHFFFAOYSA-N
XLogP1.10
TPSA92.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.35
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[4-(sulfamoylmethyl)phenyl]pyrrolidine-1-carboxamide 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-sulfamoylphenyl)azocane-1-carboxamide
CID 17414007
N-[4-(2-amino-2-sulfanylideneethyl)phenyl]pyrrolidine-1-carboxamide
CID 79161528
N-[4-(2-hydroxyethyl)phenyl]azepane-1-carboxamide
CID 79152025
N-[4-(2-amino-2-sulfanylideneethyl)phenyl]azepane-1-carboxamide
CID 79152198
N-(4-bromophenyl)azocane-1-carboxamide
CID 3245808
N-(4-butylphenyl)pyrrolidine-1-carboxamide
CID 6467545
N-[4-(ethylaminomethyl)phenyl]piperidine-1-carboxamide
CID 106911585
N-[4-[[4-(aminomethyl)benzoyl]amino]phenyl]azepane-1-carboxamide
CID 119310690
4-(pyrrolidine-1-carbonylamino)benzoic acid
CID 39732858
1-(4-methylbenzoyl)-N-[4-(sulfamoylmethyl)phenyl]piperidine-3-carboxamide
CID 55626981
N-[4-(3-hydroxypropyl)phenyl]azetidine-1-carboxamide
CID 143227744
N-(4-pyrrolidin-1-ylsulfonylphenyl)piperidine-1-carboxamide
CID 6460433

Frequently Asked Questions

What is the IUPAC name of N-[4-(sulfamoylmethyl)phenyl]pyrrolidine-1-carboxamide?
The IUPAC name of N-[4-(sulfamoylmethyl)phenyl]pyrrolidine-1-carboxamide (CID 79161755) is N-[4-(sulfamoylmethyl)phenyl]pyrrolidine-1-carboxamide.
What is the SMILES notation for N-[4-(sulfamoylmethyl)phenyl]pyrrolidine-1-carboxamide?
The canonical SMILES for N-[4-(sulfamoylmethyl)phenyl]pyrrolidine-1-carboxamide is NS(=O)(=O)Cc1ccc(NC(=O)N2CCCC2)cc1.
What is the InChIKey of N-[4-(sulfamoylmethyl)phenyl]pyrrolidine-1-carboxamide?
The InChIKey is MZQDNNYXKDURQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O3S/c13-19(17,18)9-10-3-5-11(6-4-10)14-12(16)15-7-1-2-8-15/h3-6H,1-2,7-9H2,(H,14,16)(H2,13,17,18).
What are the key properties of N-[4-(sulfamoylmethyl)phenyl]pyrrolidine-1-carboxamide?
N-[4-(sulfamoylmethyl)phenyl]pyrrolidine-1-carboxamide has a molecular weight of 283.35 g/mol, XLogP of 1.10, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(sulfamoylmethyl)phenyl]pyrrolidine-1-carboxamide is sourced from PubChem (CID 79161755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).