3-(benzenesulfonamido)-N-[3-(2-methoxyethoxy)propyl]benzamide

C19H24N2O5S — CID 55408119

IUPAC3-(benzenesulfonamido)-N-[3-(2-methoxyethoxy)propyl]benzamide
SMILESCOCCOCCCNC(=O)c1cccc(NS(=O)(=O)c2ccccc2)c1
InChIInChI=1S/C19H24N2O5S/c1-25-13-14-26-12-6-11-20-19(22)16-7-5-8-17(15-16)21-27(23,24)18-9-3-2-4-10-18/h2-5,7-10,15,21H,6,11-14H2,1H3,(H,20,22)
InChIKeyUVVVSVPZPMNGQX-UHFFFAOYSA-N
MW392.48 g/mol
LogP2.27
Rot. Bonds11

About 3-(benzenesulfonamido)-N-[3-(2-methoxyethoxy)propyl]benzamide

3-(benzenesulfonamido)-N-[3-(2-methoxyethoxy)propyl]benzamide (PubChem CID 55408119) has the molecular formula C19H24N2O5S and a molecular weight of 392.48 g/mol. Its IUPAC name is 3-(benzenesulfonamido)-N-[3-(2-methoxyethoxy)propyl]benzamide.

Molecular Properties

Compound Name3-(benzenesulfonamido)-N-[3-(2-methoxyethoxy)propyl]benzamide
PubChem CID55408119
Molecular FormulaC19H24N2O5S
Molecular Weight392.48 g/mol
Exact Mass392.14
IUPAC Name3-(benzenesulfonamido)-N-[3-(2-methoxyethoxy)propyl]benzamide
SMILESCOCCOCCCNC(=O)c1cccc(NS(=O)(=O)c2ccccc2)c1
InChIInChI=1S/C19H24N2O5S/c1-25-13-14-26-12-6-11-20-19(22)16-7-5-8-17(15-16)21-27(23,24)18-9-3-2-4-10-18/h2-5,7-10,15,21H,6,11-14H2,1H3,(H,20,22)
InChIKeyUVVVSVPZPMNGQX-UHFFFAOYSA-N
XLogP2.27
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.48
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-(2-methoxyethyl)-3-(phenylsulfamoyl)benzamide
CID 19257386
3-[(4-bromophenyl)sulfonylamino]-N-(2-methoxyethyl)benzamide
CID 18161967
3-[(3-fluorophenyl)sulfamoyl]-N-(3-methoxypropyl)benzamide
CID 109063851
3-[(3-fluoro-4-methylphenyl)sulfonylamino]-N-(3-methoxypropyl)benzamide
CID 26593247
N-(3-ethoxypropyl)-3-[(3-methylphenyl)sulfamoyl]benzamide
CID 26776167
3-[(4-methoxyphenyl)sulfamoyl]-N-(3-methoxypropyl)benzamide
CID 26593268
N-(2-methoxyethyl)-3-(pyridin-3-ylsulfonylamino)benzamide
CID 118572860
3-(benzenesulfonamido)-N-[2-(ethylamino)-2-oxoethyl]benzamide
CID 18137070
3-(benzenesulfonamido)-N-[3-(4-fluorophenyl)sulfanylpropyl]benzamide
CID 27802378
3-[(3-chlorophenyl)sulfamoyl]-N-[3-(2-methylpropoxy)propyl]benzamide
CID 24560167
3-(benzenesulfonamido)-N-[3-[3-(pyrrolidin-1-ylmethyl)phenoxy]propyl]benzamide
CID 70512568
3-(benzenesulfonamido)-N-[2-(4-propan-2-yloxyphenyl)ethyl]benzamide
CID 38502452

Frequently Asked Questions

What is the IUPAC name of 3-(benzenesulfonamido)-N-[3-(2-methoxyethoxy)propyl]benzamide?
The IUPAC name of 3-(benzenesulfonamido)-N-[3-(2-methoxyethoxy)propyl]benzamide (CID 55408119) is 3-(benzenesulfonamido)-N-[3-(2-methoxyethoxy)propyl]benzamide.
What is the SMILES notation for 3-(benzenesulfonamido)-N-[3-(2-methoxyethoxy)propyl]benzamide?
The canonical SMILES for 3-(benzenesulfonamido)-N-[3-(2-methoxyethoxy)propyl]benzamide is COCCOCCCNC(=O)c1cccc(NS(=O)(=O)c2ccccc2)c1.
What is the InChIKey of 3-(benzenesulfonamido)-N-[3-(2-methoxyethoxy)propyl]benzamide?
The InChIKey is UVVVSVPZPMNGQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O5S/c1-25-13-14-26-12-6-11-20-19(22)16-7-5-8-17(15-16)21-27(23,24)18-9-3-2-4-10-18/h2-5,7-10,15,21H,6,11-14H2,1H3,(H,20,22).
What are the key properties of 3-(benzenesulfonamido)-N-[3-(2-methoxyethoxy)propyl]benzamide?
3-(benzenesulfonamido)-N-[3-(2-methoxyethoxy)propyl]benzamide has a molecular weight of 392.48 g/mol, XLogP of 2.27, 11 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(benzenesulfonamido)-N-[3-(2-methoxyethoxy)propyl]benzamide is sourced from PubChem (CID 55408119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).