2-(benzenesulfonamido)-N-(3-methoxypropyl)benzamide

C17H20N2O4S — CID 2967457

IUPAC2-(benzenesulfonamido)-N-(3-methoxypropyl)benzamide
SMILESCOCCCNC(=O)c1ccccc1NS(=O)(=O)c1ccccc1
InChIInChI=1S/C17H20N2O4S/c1-23-13-7-12-18-17(20)15-10-5-6-11-16(15)19-24(21,22)14-8-3-2-4-9-14/h2-6,8-11,19H,7,12-13H2,1H3,(H,18,20)
InChIKeyCWTGSVXFUYLRDI-UHFFFAOYSA-N
MW348.42 g/mol
LogP2.25
Rot. Bonds8

About 2-(benzenesulfonamido)-N-(3-methoxypropyl)benzamide

2-(benzenesulfonamido)-N-(3-methoxypropyl)benzamide (PubChem CID 2967457) has the molecular formula C17H20N2O4S and a molecular weight of 348.42 g/mol. Its IUPAC name is 2-(benzenesulfonamido)-N-(3-methoxypropyl)benzamide.

Molecular Properties

Compound Name2-(benzenesulfonamido)-N-(3-methoxypropyl)benzamide
PubChem CID2967457
Molecular FormulaC17H20N2O4S
Molecular Weight348.42 g/mol
Exact Mass348.11
IUPAC Name2-(benzenesulfonamido)-N-(3-methoxypropyl)benzamide
SMILESCOCCCNC(=O)c1ccccc1NS(=O)(=O)c1ccccc1
InChIInChI=1S/C17H20N2O4S/c1-23-13-7-12-18-17(20)15-10-5-6-11-16(15)19-24(21,22)14-8-3-2-4-9-14/h2-6,8-11,19H,7,12-13H2,1H3,(H,18,20)
InChIKeyCWTGSVXFUYLRDI-UHFFFAOYSA-N
XLogP2.25
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.42
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[[4-(2,5-dioxopyrrolidin-1-yl)phenyl]sulfonylamino]-N-(3-methoxypropyl)benzamide
CID 100539081
N-(2-methoxyethyl)-2-[(4-propan-2-ylphenyl)sulfonylamino]benzamide
CID 31754216
ethyl 4-[[2-(2-methoxyethylcarbamoyl)phenyl]sulfamoyl]benzoate
CID 31754196
2-(ethylsulfonylamino)-N-(2-methoxyethyl)benzamide
CID 47141588
5-[(2-methoxyphenyl)sulfamoyl]-N-(3-methoxypropyl)-2-methylbenzamide
CID 4781193
2-(benzenesulfonamido)-N-benzylbenzamide
CID 1320833
2-[[2-(methanesulfonamido)benzoyl]amino]-N-(2-methoxyethyl)benzamide
CID 2230013
N-[3-(cyclopropylmethoxy)propyl]-2-[(4-fluorophenyl)sulfonylamino]benzamide
CID 29238978
2-(benzenesulfonamido)-N-[2-(4-chlorophenyl)sulfanylethyl]benzamide
CID 126412818
N,N'-bis[2-(3-methoxypropylcarbamoyl)phenyl]hexanediamide
CID 17148582
2-[(4-methoxy-2-methyl-5-propan-2-ylphenyl)sulfonylamino]-N-(3-methoxypropyl)benzamide
CID 100545095
2-[(2,5-dimethylphenyl)sulfonylamino]-N-(2-methoxyethyl)benzamide
CID 35990783

Frequently Asked Questions

What is the IUPAC name of 2-(benzenesulfonamido)-N-(3-methoxypropyl)benzamide?
The IUPAC name of 2-(benzenesulfonamido)-N-(3-methoxypropyl)benzamide (CID 2967457) is 2-(benzenesulfonamido)-N-(3-methoxypropyl)benzamide.
What is the SMILES notation for 2-(benzenesulfonamido)-N-(3-methoxypropyl)benzamide?
The canonical SMILES for 2-(benzenesulfonamido)-N-(3-methoxypropyl)benzamide is COCCCNC(=O)c1ccccc1NS(=O)(=O)c1ccccc1.
What is the InChIKey of 2-(benzenesulfonamido)-N-(3-methoxypropyl)benzamide?
The InChIKey is CWTGSVXFUYLRDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O4S/c1-23-13-7-12-18-17(20)15-10-5-6-11-16(15)19-24(21,22)14-8-3-2-4-9-14/h2-6,8-11,19H,7,12-13H2,1H3,(H,18,20).
What are the key properties of 2-(benzenesulfonamido)-N-(3-methoxypropyl)benzamide?
2-(benzenesulfonamido)-N-(3-methoxypropyl)benzamide has a molecular weight of 348.42 g/mol, XLogP of 2.25, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzenesulfonamido)-N-(3-methoxypropyl)benzamide is sourced from PubChem (CID 2967457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).