4-[2-(2-methoxyphenyl)piperazin-1-yl]sulfonyl-N-methylbenzamide;hydrochloride

C19H24ClN3O4S — CID 120763352

IUPAC4-[2-(2-methoxyphenyl)piperazin-1-yl]sulfonyl-N-methylbenzamide;hydrochloride
SMILESCNC(=O)c1ccc(S(=O)(=O)N2CCNCC2c2ccccc2OC)cc1.Cl
InChIInChI=1S/C19H23N3O4S.ClH/c1-20-19(23)14-7-9-15(10-8-14)27(24,25)22-12-11-21-13-17(22)16-5-3-4-6-18(16)26-2;/h3-10,17,21H,11-13H2,1-2H3,(H,20,23);1H
InChIKeyATHXYSVJKAHYPN-UHFFFAOYSA-N
MW425.94 g/mol
LogP1.81
Rot. Bonds5

About 4-[2-(2-methoxyphenyl)piperazin-1-yl]sulfonyl-N-methylbenzamide;hydrochloride

4-[2-(2-methoxyphenyl)piperazin-1-yl]sulfonyl-N-methylbenzamide;hydrochloride (PubChem CID 120763352) has the molecular formula C19H24ClN3O4S and a molecular weight of 425.94 g/mol. Its IUPAC name is 4-[2-(2-methoxyphenyl)piperazin-1-yl]sulfonyl-N-methylbenzamide;hydrochloride.

Molecular Properties

Compound Name4-[2-(2-methoxyphenyl)piperazin-1-yl]sulfonyl-N-methylbenzamide;hydrochloride
PubChem CID120763352
Molecular FormulaC19H24ClN3O4S
Molecular Weight425.94 g/mol
Exact Mass425.12
IUPAC Name4-[2-(2-methoxyphenyl)piperazin-1-yl]sulfonyl-N-methylbenzamide;hydrochloride
SMILESCNC(=O)c1ccc(S(=O)(=O)N2CCNCC2c2ccccc2OC)cc1.Cl
InChIInChI=1S/C19H23N3O4S.ClH/c1-20-19(23)14-7-9-15(10-8-14)27(24,25)22-12-11-21-13-17(22)16-5-3-4-6-18(16)26-2;/h3-10,17,21H,11-13H2,1-2H3,(H,20,23);1H
InChIKeyATHXYSVJKAHYPN-UHFFFAOYSA-N
XLogP1.81
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500425.94
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-[2-(2-methoxyphenyl)piperazin-1-yl]sulfonyl-N-methylbenzamide;hydrochloride 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-(2-methoxyphenyl)-1-(4-methoxyphenyl)sulfonylpiperazine;hydrochloride
CID 120763094
N-methyl-4-(2-methylpiperazin-1-yl)sulfonylbenzamide;hydrochloride
CID 119969796
N-methyl-4-[(2R)-2-methylpiperazin-1-yl]sulfonylbenzamide
CID 82755291
5-[2-(2-methoxyphenyl)piperazin-1-yl]sulfonyl-2-methylbenzamide;hydrochloride
CID 120763116
methyl 4-[2-(2-methoxyphenyl)piperazin-1-yl]sulfonylthiophene-2-carboxylate;hydrochloride
CID 120763445
2-(2-methoxyphenyl)-1-(2-methylphenyl)sulfonylpiperazine;hydrochloride
CID 120763471
methyl 5-[2-(2-methoxyphenyl)piperazin-1-yl]sulfonylfuran-3-carboxylate
CID 120763083
(2S)-2-(2-methoxyphenyl)-1-pyridin-3-ylsulfonylpiperazine
CID 124971463
1-(3-ethylphenyl)sulfonyl-2-(2-methoxyphenyl)piperazine
CID 120763268
1-(2,4-difluorophenyl)sulfonyl-2-(2-methoxyphenyl)piperazine;hydrochloride
CID 120763166
1-(3-chloro-2-fluorophenyl)sulfonyl-2-(2-methoxyphenyl)piperazine;hydrochloride
CID 120763415
N,N-diethyl-2-(2-methoxyphenyl)piperazine-1-sulfonamide;hydrochloride
CID 120763279

Frequently Asked Questions

What is the IUPAC name of 4-[2-(2-methoxyphenyl)piperazin-1-yl]sulfonyl-N-methylbenzamide;hydrochloride?
The IUPAC name of 4-[2-(2-methoxyphenyl)piperazin-1-yl]sulfonyl-N-methylbenzamide;hydrochloride (CID 120763352) is 4-[2-(2-methoxyphenyl)piperazin-1-yl]sulfonyl-N-methylbenzamide;hydrochloride.
What is the SMILES notation for 4-[2-(2-methoxyphenyl)piperazin-1-yl]sulfonyl-N-methylbenzamide;hydrochloride?
The canonical SMILES for 4-[2-(2-methoxyphenyl)piperazin-1-yl]sulfonyl-N-methylbenzamide;hydrochloride is CNC(=O)c1ccc(S(=O)(=O)N2CCNCC2c2ccccc2OC)cc1.Cl.
What is the InChIKey of 4-[2-(2-methoxyphenyl)piperazin-1-yl]sulfonyl-N-methylbenzamide;hydrochloride?
The InChIKey is ATHXYSVJKAHYPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O4S.ClH/c1-20-19(23)14-7-9-15(10-8-14)27(24,25)22-12-11-21-13-17(22)16-5-3-4-6-18(16)26-2;/h3-10,17,21H,11-13H2,1-2H3,(H,20,23);1H.
What are the key properties of 4-[2-(2-methoxyphenyl)piperazin-1-yl]sulfonyl-N-methylbenzamide;hydrochloride?
4-[2-(2-methoxyphenyl)piperazin-1-yl]sulfonyl-N-methylbenzamide;hydrochloride has a molecular weight of 425.94 g/mol, XLogP of 1.81, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(2-methoxyphenyl)piperazin-1-yl]sulfonyl-N-methylbenzamide;hydrochloride is sourced from PubChem (CID 120763352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).