N-ethyl-N-[(2-methoxypyrrolidin-2-yl)methyl]-3-sulfamoylbenzamide

C15H23N3O4S — CID 70500289

IUPACN-ethyl-N-[(2-methoxypyrrolidin-2-yl)methyl]-3-sulfamoylbenzamide
SMILESCCN(CC1(OC)CCCN1)C(=O)c1cccc(S(N)(=O)=O)c1
InChIInChI=1S/C15H23N3O4S/c1-3-18(11-15(22-2)8-5-9-17-15)14(19)12-6-4-7-13(10-12)23(16,20)21/h4,6-7,10,17H,3,5,8-9,11H2,1-2H3,(H2,16,20,21)
InChIKeyFNDMHMQCHMMUMO-UHFFFAOYSA-N
MW341.43 g/mol
LogP0.52
Rot. Bonds6

About N-ethyl-N-[(2-methoxypyrrolidin-2-yl)methyl]-3-sulfamoylbenzamide

N-ethyl-N-[(2-methoxypyrrolidin-2-yl)methyl]-3-sulfamoylbenzamide (PubChem CID 70500289) has the molecular formula C15H23N3O4S and a molecular weight of 341.43 g/mol. Its IUPAC name is N-ethyl-N-[(2-methoxypyrrolidin-2-yl)methyl]-3-sulfamoylbenzamide.

Molecular Properties

Compound NameN-ethyl-N-[(2-methoxypyrrolidin-2-yl)methyl]-3-sulfamoylbenzamide
PubChem CID70500289
Molecular FormulaC15H23N3O4S
Molecular Weight341.43 g/mol
Exact Mass341.14
IUPAC NameN-ethyl-N-[(2-methoxypyrrolidin-2-yl)methyl]-3-sulfamoylbenzamide
SMILESCCN(CC1(OC)CCCN1)C(=O)c1cccc(S(N)(=O)=O)c1
InChIInChI=1S/C15H23N3O4S/c1-3-18(11-15(22-2)8-5-9-17-15)14(19)12-6-4-7-13(10-12)23(16,20)21/h4,6-7,10,17H,3,5,8-9,11H2,1-2H3,(H2,16,20,21)
InChIKeyFNDMHMQCHMMUMO-UHFFFAOYSA-N
XLogP0.52
TPSA101.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.43
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-ethyl-N-[(2-methoxypyrrolidin-2-yl)methyl]-3-sulfamoylbenzamide 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,N-dimethoxy-3-sulfamoylbenzamide
CID 54347456
3-butanoylbenzenesulfonamide
CID 63839666
N-(2-aminoethyl)-N-ethyl-3-methylsulfonylbenzamide
CID 61348545
N-propan-2-yl-N-propyl-3-sulfamoylbenzamide
CID 43269913
N-ethyl-3-sulfamoylbenzamide
CID 43089872
N-cyclopropyl-N-methyl-3-sulfamoylbenzamide
CID 43265275
N,N-diethyl-3-[(2-methylphenyl)sulfamoyl]benzamide
CID 109065077
N,N-diethyl-3-(3-methoxypropylsulfamoyl)benzamide
CID 109063741
2-[[3-(cyclopropylsulfamoyl)benzoyl]-ethylamino]acetic acid
CID 119206284
N-methyl-N-[(2-methylcyclopropyl)methyl]-3-sulfamoylbenzamide
CID 55258090
methyl 1-[[3-[ethyl(phenyl)sulfamoyl]benzoyl]amino]cyclopentane-1-carboxylate
CID 55572752
ethyl 1-[[3-(dimethylsulfamoyl)benzoyl]amino]cyclohexane-1-carboxylate
CID 55969208

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[(2-methoxypyrrolidin-2-yl)methyl]-3-sulfamoylbenzamide?
The IUPAC name of N-ethyl-N-[(2-methoxypyrrolidin-2-yl)methyl]-3-sulfamoylbenzamide (CID 70500289) is N-ethyl-N-[(2-methoxypyrrolidin-2-yl)methyl]-3-sulfamoylbenzamide.
What is the SMILES notation for N-ethyl-N-[(2-methoxypyrrolidin-2-yl)methyl]-3-sulfamoylbenzamide?
The canonical SMILES for N-ethyl-N-[(2-methoxypyrrolidin-2-yl)methyl]-3-sulfamoylbenzamide is CCN(CC1(OC)CCCN1)C(=O)c1cccc(S(N)(=O)=O)c1.
What is the InChIKey of N-ethyl-N-[(2-methoxypyrrolidin-2-yl)methyl]-3-sulfamoylbenzamide?
The InChIKey is FNDMHMQCHMMUMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O4S/c1-3-18(11-15(22-2)8-5-9-17-15)14(19)12-6-4-7-13(10-12)23(16,20)21/h4,6-7,10,17H,3,5,8-9,11H2,1-2H3,(H2,16,20,21).
What are the key properties of N-ethyl-N-[(2-methoxypyrrolidin-2-yl)methyl]-3-sulfamoylbenzamide?
N-ethyl-N-[(2-methoxypyrrolidin-2-yl)methyl]-3-sulfamoylbenzamide has a molecular weight of 341.43 g/mol, XLogP of 0.52, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[(2-methoxypyrrolidin-2-yl)methyl]-3-sulfamoylbenzamide is sourced from PubChem (CID 70500289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).