N-(4-methylphenyl)sulfonyl-N-phenylfuran-2-carboxamide

C18H15NO4S — CID 19210436

IUPACN-(4-methylphenyl)sulfonyl-N-phenylfuran-2-carboxamide
SMILESCc1ccc(S(=O)(=O)N(C(=O)c2ccco2)c2ccccc2)cc1
InChIInChI=1S/C18H15NO4S/c1-14-9-11-16(12-10-14)24(21,22)19(15-6-3-2-4-7-15)18(20)17-8-5-13-23-17/h2-13H,1H3
InChIKeyZHRNDUNHNHITPD-UHFFFAOYSA-N
MW341.39 g/mol
LogP3.62
Rot. Bonds4

About N-(4-methylphenyl)sulfonyl-N-phenylfuran-2-carboxamide

N-(4-methylphenyl)sulfonyl-N-phenylfuran-2-carboxamide (PubChem CID 19210436) has the molecular formula C18H15NO4S and a molecular weight of 341.39 g/mol. Its IUPAC name is N-(4-methylphenyl)sulfonyl-N-phenylfuran-2-carboxamide.

Molecular Properties

Compound NameN-(4-methylphenyl)sulfonyl-N-phenylfuran-2-carboxamide
PubChem CID19210436
Molecular FormulaC18H15NO4S
Molecular Weight341.39 g/mol
Exact Mass341.07
IUPAC NameN-(4-methylphenyl)sulfonyl-N-phenylfuran-2-carboxamide
SMILESCc1ccc(S(=O)(=O)N(C(=O)c2ccco2)c2ccccc2)cc1
InChIInChI=1S/C18H15NO4S/c1-14-9-11-16(12-10-14)24(21,22)19(15-6-3-2-4-7-15)18(20)17-8-5-13-23-17/h2-13H,1H3
InChIKeyZHRNDUNHNHITPD-UHFFFAOYSA-N
XLogP3.62
TPSA67.59 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.39
LogP ≤ 53.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-butylphenyl)-N-(4-methylphenyl)sulfonylfuran-2-carboxamide
CID 19210446
N-(4-chlorophenyl)sulfonyl-N-(2,5-dimethylphenyl)furan-2-carboxamide
CID 19210451
3-methyl-N-(4-methylphenyl)sulfonyl-N-phenylbut-2-enamide
CID 19210572
3,3-dimethyl-N-(4-methylphenyl)sulfonyl-N-phenylbutanamide
CID 19219305
N-(benzenesulfonyl)-N-(4-methylphenyl)-2-(2-phenylethyl)benzamide
CID 19210199
N-(benzenesulfonyl)-2-bromo-N-(4-methylphenyl)benzamide
CID 19210740
2-methoxy-N-(4-methylphenyl)-N-(4-methylphenyl)sulfonylbenzamide
CID 1322535
N-(4-butylphenyl)-N-(4-methylphenyl)sulfonylbenzamide
CID 19210617
N-(4-methylphenyl)sulfonyl-N-phenylcyclohexanecarboxamide
CID 19210513
N-(benzenesulfonyl)-N-(4-methylphenyl)-3,5-dinitrobenzamide
CID 19210790
N-(4-methylphenyl)-N-(4-methylphenyl)sulfonylthiophene-2-carboxamide
CID 19210463
N-(4-methoxyphenyl)-N-(4-methylphenyl)sulfonyl-2-(2-phenylethyl)benzamide
CID 19210204

Frequently Asked Questions

What is the IUPAC name of N-(4-methylphenyl)sulfonyl-N-phenylfuran-2-carboxamide?
The IUPAC name of N-(4-methylphenyl)sulfonyl-N-phenylfuran-2-carboxamide (CID 19210436) is N-(4-methylphenyl)sulfonyl-N-phenylfuran-2-carboxamide.
What is the SMILES notation for N-(4-methylphenyl)sulfonyl-N-phenylfuran-2-carboxamide?
The canonical SMILES for N-(4-methylphenyl)sulfonyl-N-phenylfuran-2-carboxamide is Cc1ccc(S(=O)(=O)N(C(=O)c2ccco2)c2ccccc2)cc1.
What is the InChIKey of N-(4-methylphenyl)sulfonyl-N-phenylfuran-2-carboxamide?
The InChIKey is ZHRNDUNHNHITPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15NO4S/c1-14-9-11-16(12-10-14)24(21,22)19(15-6-3-2-4-7-15)18(20)17-8-5-13-23-17/h2-13H,1H3.
What are the key properties of N-(4-methylphenyl)sulfonyl-N-phenylfuran-2-carboxamide?
N-(4-methylphenyl)sulfonyl-N-phenylfuran-2-carboxamide has a molecular weight of 341.39 g/mol, XLogP of 3.62, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylphenyl)sulfonyl-N-phenylfuran-2-carboxamide is sourced from PubChem (CID 19210436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).