N-(4-aminophenyl)sulfonyl-4-methoxybenzamide

C14H14N2O4S — CID 90673049

IUPACN-(4-aminophenyl)sulfonyl-4-methoxybenzamide
SMILESCOc1ccc(C(=O)NS(=O)(=O)c2ccc(N)cc2)cc1
InChIInChI=1S/C14H14N2O4S/c1-20-12-6-2-10(3-7-12)14(17)16-21(18,19)13-8-4-11(15)5-9-13/h2-9H,15H2,1H3,(H,16,17)
InChIKeyOGSNJWKDRUNDJK-UHFFFAOYSA-N
MW306.34 g/mol
LogP1.40
Rot. Bonds4

About N-(4-aminophenyl)sulfonyl-4-methoxybenzamide

N-(4-aminophenyl)sulfonyl-4-methoxybenzamide (PubChem CID 90673049) has the molecular formula C14H14N2O4S and a molecular weight of 306.34 g/mol. Its IUPAC name is N-(4-aminophenyl)sulfonyl-4-methoxybenzamide.

Molecular Properties

Compound NameN-(4-aminophenyl)sulfonyl-4-methoxybenzamide
PubChem CID90673049
Molecular FormulaC14H14N2O4S
Molecular Weight306.34 g/mol
Exact Mass306.07
IUPAC NameN-(4-aminophenyl)sulfonyl-4-methoxybenzamide
SMILESCOc1ccc(C(=O)NS(=O)(=O)c2ccc(N)cc2)cc1
InChIInChI=1S/C14H14N2O4S/c1-20-12-6-2-10(3-7-12)14(17)16-21(18,19)13-8-4-11(15)5-9-13/h2-9H,15H2,1H3,(H,16,17)
InChIKeyOGSNJWKDRUNDJK-UHFFFAOYSA-N
XLogP1.40
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.34
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

4-methoxy-N-[4-(phenylcarbamothioylamino)phenyl]sulfonylbenzamide
CID 22921499
5-[(4-methoxyphenyl)sulfonylcarbamoyl]pyridine-2-carboxylic acid
CID 19928409
N'-(4-methoxyphenyl)sulfonyloxamide
CID 68844028
potassium methyl N-(4-aminophenyl)sulfonylcarbamate
CID 20981828
1-(4-aminophenyl)-3-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]urea
CID 166423475
4-(4-methoxyphenoxy)-N-methylsulfonylbenzamide
CID 66767279
4-methoxy-N-(1-methoxyethenyl)benzenesulfonamide
CID 117059157
N-(4-methoxyphenyl)sulfonyl-3-nitrobenzamide
CID 22007146
N-(4-carbamoylphenyl)sulfonyl-4-(methoxymethyl)benzamide
CID 56795776
4-amino-N-[(1S)-1-(4-methoxyphenyl)ethyl]benzamide
CID 81364308
N'-(benzenesulfonyl)-4-methoxybenzohydrazide
CID 795528
1-[(4-aminophenyl)-methylidene-oxo-λ6-sulfanyl]-3-(4-methoxyphenyl)urea
CID 91476086

Frequently Asked Questions

What is the IUPAC name of N-(4-aminophenyl)sulfonyl-4-methoxybenzamide?
The IUPAC name of N-(4-aminophenyl)sulfonyl-4-methoxybenzamide (CID 90673049) is N-(4-aminophenyl)sulfonyl-4-methoxybenzamide.
What is the SMILES notation for N-(4-aminophenyl)sulfonyl-4-methoxybenzamide?
The canonical SMILES for N-(4-aminophenyl)sulfonyl-4-methoxybenzamide is COc1ccc(C(=O)NS(=O)(=O)c2ccc(N)cc2)cc1.
What is the InChIKey of N-(4-aminophenyl)sulfonyl-4-methoxybenzamide?
The InChIKey is OGSNJWKDRUNDJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O4S/c1-20-12-6-2-10(3-7-12)14(17)16-21(18,19)13-8-4-11(15)5-9-13/h2-9H,15H2,1H3,(H,16,17).
What are the key properties of N-(4-aminophenyl)sulfonyl-4-methoxybenzamide?
N-(4-aminophenyl)sulfonyl-4-methoxybenzamide has a molecular weight of 306.34 g/mol, XLogP of 1.40, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminophenyl)sulfonyl-4-methoxybenzamide is sourced from PubChem (CID 90673049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).