2-[[3-[(2-methoxyphenyl)sulfamoyl]benzoyl]amino]-N-prop-2-enylbenzamide

C24H23N3O5S — CID 34743144

IUPAC2-[[3-[(2-methoxyphenyl)sulfamoyl]benzoyl]amino]-N-prop-2-enylbenzamide
SMILESC=CCNC(=O)c1ccccc1NC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1
InChIInChI=1S/C24H23N3O5S/c1-3-15-25-24(29)19-11-4-5-12-20(19)26-23(28)17-9-8-10-18(16-17)33(30,31)27-21-13-6-7-14-22(21)32-2/h3-14,16,27H,1,15H2,2H3,(H,25,29)(H,26,28)
InChIKeyQWXCNPQWRLBJID-UHFFFAOYSA-N
MW465.53 g/mol
LogP3.66
Rot. Bonds9

About 2-[[3-[(2-methoxyphenyl)sulfamoyl]benzoyl]amino]-N-prop-2-enylbenzamide

2-[[3-[(2-methoxyphenyl)sulfamoyl]benzoyl]amino]-N-prop-2-enylbenzamide (PubChem CID 34743144) has the molecular formula C24H23N3O5S and a molecular weight of 465.53 g/mol. Its IUPAC name is 2-[[3-[(2-methoxyphenyl)sulfamoyl]benzoyl]amino]-N-prop-2-enylbenzamide.

Molecular Properties

Compound Name2-[[3-[(2-methoxyphenyl)sulfamoyl]benzoyl]amino]-N-prop-2-enylbenzamide
PubChem CID34743144
Molecular FormulaC24H23N3O5S
Molecular Weight465.53 g/mol
Exact Mass465.14
IUPAC Name2-[[3-[(2-methoxyphenyl)sulfamoyl]benzoyl]amino]-N-prop-2-enylbenzamide
SMILESC=CCNC(=O)c1ccccc1NC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1
InChIInChI=1S/C24H23N3O5S/c1-3-15-25-24(29)19-11-4-5-12-20(19)26-23(28)17-9-8-10-18(16-17)33(30,31)27-21-13-6-7-14-22(21)32-2/h3-14,16,27H,1,15H2,2H3,(H,25,29)(H,26,28)
InChIKeyQWXCNPQWRLBJID-UHFFFAOYSA-N
XLogP3.66
TPSA113.60 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500465.53
LogP ≤ 53.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-(2-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide
CID 26538254
3-[(2-ethoxyphenyl)sulfamoyl]-N-prop-2-enylbenzamide
CID 109062466
2-[[3-(benzenesulfonamido)benzoyl]amino]-N-prop-2-enylbenzamide
CID 41448837
2-[(3-fluoro-4-methoxyphenyl)sulfonylamino]-N-prop-2-enylbenzamide
CID 39827756
N-prop-2-enyl-2-[[3-(2,2,2-trifluoroethylcarbamoyl)phenyl]sulfonylamino]benzamide
CID 55879588
2-[(2-methoxyphenyl)sulfonylamino]-N-prop-2-enylbenzamide
CID 51170213
3-[(2-methoxyphenyl)sulfamoyl]-N-(2-methylpropyl)benzamide
CID 51163765
N-benzyl-3-[(2-methoxyphenyl)sulfamoyl]benzamide
CID 2329574
3-[(2-methoxyphenyl)methylsulfamoyl]-N-prop-2-enylbenzamide
CID 94633826
N-(3-hydroxy-5-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide
CID 75452209
2-[(3-fluorobenzoyl)amino]-N-prop-2-enylbenzamide
CID 6461650
3-[[(2-ethoxypyridine-3-carbonyl)amino]carbamoyl]-N-(2-methoxyphenyl)benzenesulfonamide
CID 24540494

Frequently Asked Questions

What is the IUPAC name of 2-[[3-[(2-methoxyphenyl)sulfamoyl]benzoyl]amino]-N-prop-2-enylbenzamide?
The IUPAC name of 2-[[3-[(2-methoxyphenyl)sulfamoyl]benzoyl]amino]-N-prop-2-enylbenzamide (CID 34743144) is 2-[[3-[(2-methoxyphenyl)sulfamoyl]benzoyl]amino]-N-prop-2-enylbenzamide.
What is the SMILES notation for 2-[[3-[(2-methoxyphenyl)sulfamoyl]benzoyl]amino]-N-prop-2-enylbenzamide?
The canonical SMILES for 2-[[3-[(2-methoxyphenyl)sulfamoyl]benzoyl]amino]-N-prop-2-enylbenzamide is C=CCNC(=O)c1ccccc1NC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1.
What is the InChIKey of 2-[[3-[(2-methoxyphenyl)sulfamoyl]benzoyl]amino]-N-prop-2-enylbenzamide?
The InChIKey is QWXCNPQWRLBJID-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3O5S/c1-3-15-25-24(29)19-11-4-5-12-20(19)26-23(28)17-9-8-10-18(16-17)33(30,31)27-21-13-6-7-14-22(21)32-2/h3-14,16,27H,1,15H2,2H3,(H,25,29)(H,26,28).
What are the key properties of 2-[[3-[(2-methoxyphenyl)sulfamoyl]benzoyl]amino]-N-prop-2-enylbenzamide?
2-[[3-[(2-methoxyphenyl)sulfamoyl]benzoyl]amino]-N-prop-2-enylbenzamide has a molecular weight of 465.53 g/mol, XLogP of 3.66, 9 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[3-[(2-methoxyphenyl)sulfamoyl]benzoyl]amino]-N-prop-2-enylbenzamide is sourced from PubChem (CID 34743144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).