N-(4-{[methyl(phenyl)amino]sulfonyl}phenyl)-2-furamide

C18H16N2O4S — CID 1244950

IUPACN-[4-[methyl(phenyl)sulfamoyl]phenyl]furan-2-carboxamide
SMILESCN(C1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CO3
InChIInChI=1S/C18H16N2O4S/c1-20(15-6-3-2-4-7-15)25(22,23)16-11-9-14(10-12-16)19-18(21)17-8-5-13-24-17/h2-13H,1H3,(H,19,21)
InChIKeyYDLXVACJVUFWFZ-UHFFFAOYSA-N
MW356.40 g/mol
LogP2.90
Rot. Bonds5

About N-(4-{[methyl(phenyl)amino]sulfonyl}phenyl)-2-furamide

N-(4-{[methyl(phenyl)amino]sulfonyl}phenyl)-2-furamide (PubChem CID 1244950) has the molecular formula C18H16N2O4S and a molecular weight of 356.40 g/mol. Its IUPAC name is N-[4-[methyl(phenyl)sulfamoyl]phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-(4-{[methyl(phenyl)amino]sulfonyl}phenyl)-2-furamide
PubChem CID1244950
Molecular FormulaC18H16N2O4S
Molecular Weight356.40 g/mol
Exact Mass356.08
IUPAC NameN-[4-[methyl(phenyl)sulfamoyl]phenyl]furan-2-carboxamide
SMILESCN(C1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CO3
InChIInChI=1S/C18H16N2O4S/c1-20(15-6-3-2-4-7-15)25(22,23)16-11-9-14(10-12-16)19-18(21)17-8-5-13-24-17/h2-13H,1H3,(H,19,21)
InChIKeyYDLXVACJVUFWFZ-UHFFFAOYSA-N
XLogP2.90
TPSA88.00 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity546

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.40
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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3-Furan-2-yl-N-(4-sulfamoylphenyl)acrylamide
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N-[3-[(2-fluorophenyl)sulfamoyl]phenyl]furan-2-carboxamide
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CID 871981
(2E)-3-(5-methylfuran-2-yl)-N-(4-sulfamoylphenyl)prop-2-enamide
CID 712926
Cambridge id 5798025
CID 744285
2-[4-(Furan-2-carbonyl)-piperazin-1-yl]-N-phenyl-acetamide
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[2-Oxo-2-(4-sulfamoylanilino)ethyl] furan-2-carboxylate
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N-(furan-2-ylmethyl)-3-[phenyl(prop-2-enyl)sulfamoyl]benzamide
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Frequently Asked Questions

What is the IUPAC name of N-(4-{[methyl(phenyl)amino]sulfonyl}phenyl)-2-furamide?
The IUPAC name of N-(4-{[methyl(phenyl)amino]sulfonyl}phenyl)-2-furamide (CID 1244950) is N-[4-[methyl(phenyl)sulfamoyl]phenyl]furan-2-carboxamide.
What is the SMILES notation for N-(4-{[methyl(phenyl)amino]sulfonyl}phenyl)-2-furamide?
The canonical SMILES for N-(4-{[methyl(phenyl)amino]sulfonyl}phenyl)-2-furamide is CN(C1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CO3.
What is the InChIKey of N-(4-{[methyl(phenyl)amino]sulfonyl}phenyl)-2-furamide?
The InChIKey is YDLXVACJVUFWFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O4S/c1-20(15-6-3-2-4-7-15)25(22,23)16-11-9-14(10-12-16)19-18(21)17-8-5-13-24-17/h2-13H,1H3,(H,19,21).
What are the key properties of N-(4-{[methyl(phenyl)amino]sulfonyl}phenyl)-2-furamide?
N-(4-{[methyl(phenyl)amino]sulfonyl}phenyl)-2-furamide has a molecular weight of 356.40 g/mol, XLogP of 2.90, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-{[methyl(phenyl)amino]sulfonyl}phenyl)-2-furamide is sourced from PubChem (CID 1244950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).