N-methyl-4-[2-[(2R)-pyrrolidin-2-yl]ethylsulfamoyl]benzamide

C14H21N3O3S — CID 104972549

IUPACN-methyl-4-[2-[(2R)-pyrrolidin-2-yl]ethylsulfamoyl]benzamide
SMILESCNC(=O)c1ccc(S(=O)(=O)NCC[C@H]2CCCN2)cc1
InChIInChI=1S/C14H21N3O3S/c1-15-14(18)11-4-6-13(7-5-11)21(19,20)17-10-8-12-3-2-9-16-12/h4-7,12,16-17H,2-3,8-10H2,1H3,(H,15,18)/t12-/m1/s1
InChIKeyWYWMFYLIKSRZDY-GFCCVEGCSA-N
MW311.41 g/mol
LogP0.47
Rot. Bonds6

About N-methyl-4-[2-[(2R)-pyrrolidin-2-yl]ethylsulfamoyl]benzamide

N-methyl-4-[2-[(2R)-pyrrolidin-2-yl]ethylsulfamoyl]benzamide (PubChem CID 104972549) has the molecular formula C14H21N3O3S and a molecular weight of 311.41 g/mol. Its IUPAC name is N-methyl-4-[2-[(2R)-pyrrolidin-2-yl]ethylsulfamoyl]benzamide.

Molecular Properties

Compound NameN-methyl-4-[2-[(2R)-pyrrolidin-2-yl]ethylsulfamoyl]benzamide
PubChem CID104972549
Molecular FormulaC14H21N3O3S
Molecular Weight311.41 g/mol
Exact Mass311.13
IUPAC NameN-methyl-4-[2-[(2R)-pyrrolidin-2-yl]ethylsulfamoyl]benzamide
SMILESCNC(=O)c1ccc(S(=O)(=O)NCC[C@H]2CCCN2)cc1
InChIInChI=1S/C14H21N3O3S/c1-15-14(18)11-4-6-13(7-5-11)21(19,20)17-10-8-12-3-2-9-16-12/h4-7,12,16-17H,2-3,8-10H2,1H3,(H,15,18)/t12-/m1/s1
InChIKeyWYWMFYLIKSRZDY-GFCCVEGCSA-N
XLogP0.47
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.41
LogP ≤ 50.47
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-methyl-4-[2-[(2R)-pyrrolidin-2-yl]ethylsulfamoyl]benzamide 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

4-ethyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]benzenesulfonamide
CID 104972462
4-propyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]benzenesulfonamide;hydrochloride
CID 120723443
4-nitro-N-(2-pyrrolidin-2-ylethyl)benzenesulfonamide
CID 57035740
N-[2-[(2S)-pyrrolidin-2-yl]ethyl]-2,3-dihydro-1H-indene-5-sulfonamide
CID 104972659
3,4-dichloro-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]benzenesulfonamide;hydrochloride
CID 120723468
1-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyrrole-3-sulfonamide
CID 104972646
3-cyano-4-fluoro-N-(2-pyrrolidin-2-ylethyl)benzenesulfonamide
CID 114794187
3-chloro-4-cyano-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]benzenesulfonamide
CID 104972674
N-(pyrrolidin-2-ylmethyl)-4-(2-thiophen-2-ylethylsulfamoyl)benzamide
CID 119512591
1-methyl-N-(2-pyrrolidin-2-ylethyl)pyrazole-4-sulfonamide
CID 114794170
4-ethoxy-3-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]benzenesulfonamide
CID 104972556
N-methyl-4-(pyrrolidin-3-ylmethylsulfamoyl)benzamide;hydrochloride
CID 120721010

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-[2-[(2R)-pyrrolidin-2-yl]ethylsulfamoyl]benzamide?
The IUPAC name of N-methyl-4-[2-[(2R)-pyrrolidin-2-yl]ethylsulfamoyl]benzamide (CID 104972549) is N-methyl-4-[2-[(2R)-pyrrolidin-2-yl]ethylsulfamoyl]benzamide.
What is the SMILES notation for N-methyl-4-[2-[(2R)-pyrrolidin-2-yl]ethylsulfamoyl]benzamide?
The canonical SMILES for N-methyl-4-[2-[(2R)-pyrrolidin-2-yl]ethylsulfamoyl]benzamide is CNC(=O)c1ccc(S(=O)(=O)NCC[C@H]2CCCN2)cc1.
What is the InChIKey of N-methyl-4-[2-[(2R)-pyrrolidin-2-yl]ethylsulfamoyl]benzamide?
The InChIKey is WYWMFYLIKSRZDY-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H21N3O3S/c1-15-14(18)11-4-6-13(7-5-11)21(19,20)17-10-8-12-3-2-9-16-12/h4-7,12,16-17H,2-3,8-10H2,1H3,(H,15,18)/t12-/m1/s1.
What are the key properties of N-methyl-4-[2-[(2R)-pyrrolidin-2-yl]ethylsulfamoyl]benzamide?
N-methyl-4-[2-[(2R)-pyrrolidin-2-yl]ethylsulfamoyl]benzamide has a molecular weight of 311.41 g/mol, XLogP of 0.47, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-[2-[(2R)-pyrrolidin-2-yl]ethylsulfamoyl]benzamide is sourced from PubChem (CID 104972549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).