N-[4-[[(4-methoxybenzoyl)amino]sulfamoyl]phenyl]acetamide

C16H17N3O5S — CID 3390773

IUPACN-[4-[[(4-methoxybenzoyl)amino]sulfamoyl]phenyl]acetamide
SMILESCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(NC(C)=O)cc2)cc1
InChIInChI=1S/C16H17N3O5S/c1-11(20)17-13-5-9-15(10-6-13)25(22,23)19-18-16(21)12-3-7-14(24-2)8-4-12/h3-10,19H,1-2H3,(H,17,20)(H,18,21)
InChIKeyWELZWHNLPBVXAN-UHFFFAOYSA-N
MW363.40 g/mol
LogP1.28
Rot. Bonds6

About N-[4-[[(4-methoxybenzoyl)amino]sulfamoyl]phenyl]acetamide

N-[4-[[(4-methoxybenzoyl)amino]sulfamoyl]phenyl]acetamide (PubChem CID 3390773) has the molecular formula C16H17N3O5S and a molecular weight of 363.40 g/mol. Its IUPAC name is N-[4-[[(4-methoxybenzoyl)amino]sulfamoyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[[(4-methoxybenzoyl)amino]sulfamoyl]phenyl]acetamide
PubChem CID3390773
Molecular FormulaC16H17N3O5S
Molecular Weight363.40 g/mol
Exact Mass363.09
IUPAC NameN-[4-[[(4-methoxybenzoyl)amino]sulfamoyl]phenyl]acetamide
SMILESCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(NC(C)=O)cc2)cc1
InChIInChI=1S/C16H17N3O5S/c1-11(20)17-13-5-9-15(10-6-13)25(22,23)19-18-16(21)12-3-7-14(24-2)8-4-12/h3-10,19H,1-2H3,(H,17,20)(H,18,21)
InChIKeyWELZWHNLPBVXAN-UHFFFAOYSA-N
XLogP1.28
TPSA113.60 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.40
LogP ≤ 51.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[4-[[(4-methoxyphenyl)carbamothioylamino]sulfamoyl]phenyl]acetamide
CID 2204943
N'-(benzenesulfonyl)-4-methoxybenzohydrazide
CID 795528
4-(ethylsulfamoyl)-N-(4-methoxyphenyl)benzamide
CID 9411925
N-(4-methoxyphenyl)-4-(propan-2-ylsulfamoyl)benzamide
CID 25400706
N-[4-(4-acetamidoanilino)phenyl]-4-methoxybenzamide
CID 112988363
N-(4-methoxyphenyl)acetamide;sulfuryl dichloride
CID 88785543
N'-(4-acetylphenyl)sulfonyl-4-ethoxybenzohydrazide
CID 8617244
N-[4-[[(3-bromobenzoyl)amino]sulfamoyl]phenyl]acetamide
CID 1272823
4-[[(4-acetamidophenyl)sulfonylamino]methyl]-N-[2-(4-methoxyphenyl)ethyl]benzamide
CID 27548773
N-[4-[[(4-methylphenyl)sulfonylamino]carbamoyl]phenyl]benzamide
CID 3293465
N-(4-methoxyphenyl)-4-(prop-2-enylsulfamoyl)benzamide
CID 19258037
N-[4-[[2-(4-methoxyphenyl)-2-methylpropyl]sulfamoyl]phenyl]acetamide
CID 113090514

Frequently Asked Questions

What is the IUPAC name of N-[4-[[(4-methoxybenzoyl)amino]sulfamoyl]phenyl]acetamide?
The IUPAC name of N-[4-[[(4-methoxybenzoyl)amino]sulfamoyl]phenyl]acetamide (CID 3390773) is N-[4-[[(4-methoxybenzoyl)amino]sulfamoyl]phenyl]acetamide.
What is the SMILES notation for N-[4-[[(4-methoxybenzoyl)amino]sulfamoyl]phenyl]acetamide?
The canonical SMILES for N-[4-[[(4-methoxybenzoyl)amino]sulfamoyl]phenyl]acetamide is COc1ccc(C(=O)NNS(=O)(=O)c2ccc(NC(C)=O)cc2)cc1.
What is the InChIKey of N-[4-[[(4-methoxybenzoyl)amino]sulfamoyl]phenyl]acetamide?
The InChIKey is WELZWHNLPBVXAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O5S/c1-11(20)17-13-5-9-15(10-6-13)25(22,23)19-18-16(21)12-3-7-14(24-2)8-4-12/h3-10,19H,1-2H3,(H,17,20)(H,18,21).
What are the key properties of N-[4-[[(4-methoxybenzoyl)amino]sulfamoyl]phenyl]acetamide?
N-[4-[[(4-methoxybenzoyl)amino]sulfamoyl]phenyl]acetamide has a molecular weight of 363.40 g/mol, XLogP of 1.28, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[[(4-methoxybenzoyl)amino]sulfamoyl]phenyl]acetamide is sourced from PubChem (CID 3390773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).