N-(3-methylphenyl)sulfonylfuran-2-carboxamide

C12H11NO4S — CID 47130299

IUPACN-(3-methylphenyl)sulfonylfuran-2-carboxamide
SMILESCc1cccc(S(=O)(=O)NC(=O)c2ccco2)c1
InChIInChI=1S/C12H11NO4S/c1-9-4-2-5-10(8-9)18(15,16)13-12(14)11-6-3-7-17-11/h2-8H,1H3,(H,13,14)
InChIKeyFJFJJSOEOQSALT-UHFFFAOYSA-N
MW265.29 g/mol
LogP1.71
Rot. Bonds3

About N-(3-methylphenyl)sulfonylfuran-2-carboxamide

N-(3-methylphenyl)sulfonylfuran-2-carboxamide (PubChem CID 47130299) has the molecular formula C12H11NO4S and a molecular weight of 265.29 g/mol. Its IUPAC name is N-(3-methylphenyl)sulfonylfuran-2-carboxamide.

Molecular Properties

Compound NameN-(3-methylphenyl)sulfonylfuran-2-carboxamide
PubChem CID47130299
Molecular FormulaC12H11NO4S
Molecular Weight265.29 g/mol
Exact Mass265.04
IUPAC NameN-(3-methylphenyl)sulfonylfuran-2-carboxamide
SMILESCc1cccc(S(=O)(=O)NC(=O)c2ccco2)c1
InChIInChI=1S/C12H11NO4S/c1-9-4-2-5-10(8-9)18(15,16)13-12(14)11-6-3-7-17-11/h2-8H,1H3,(H,13,14)
InChIKeyFJFJJSOEOQSALT-UHFFFAOYSA-N
XLogP1.71
TPSA76.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.29
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3-methylphenyl)sulfonylurea
CID 46224904
2,2-dimethyl-N-(3-methylphenyl)sulfonylpropanamide
CID 47130286
N-[4-(dimethylcarbamoylamino)phenyl]sulfonylfuran-2-carboxamide
CID 15097316
N-chloro-3-methylbenzenesulfonamide
CID 18672211
N'-(4-methyl-3-nitrophenyl)sulfonylfuran-2-carbohydrazide
CID 8616963
N'-[3-(trifluoromethyl)phenyl]sulfonylfuran-2-carbohydrazide
CID 8616858
N-[4-[(2,5-dimethylphenyl)sulfamoyl]phenyl]furan-2-carboxamide
CID 648040
N,3-dimethylbenzenesulfonamide;ethane
CID 143402177
N-(5-chlorothiophen-2-yl)sulfonylfuran-2-carboxamide
CID 47108903
5-chloro-N-(3-methylphenyl)sulfonyl-2,3-dihydro-1,4-benzodioxine-7-carboxamide
CID 71894447
3-methyl-N-(2-oxopropyl)benzenesulfonamide
CID 64994475
1-(3-methylphenyl)sulfonyl-3-[6-[(3-methylphenyl)sulfonylcarbamoylamino]hex-3-ynyl]urea
CID 24964016

Frequently Asked Questions

What is the IUPAC name of N-(3-methylphenyl)sulfonylfuran-2-carboxamide?
The IUPAC name of N-(3-methylphenyl)sulfonylfuran-2-carboxamide (CID 47130299) is N-(3-methylphenyl)sulfonylfuran-2-carboxamide.
What is the SMILES notation for N-(3-methylphenyl)sulfonylfuran-2-carboxamide?
The canonical SMILES for N-(3-methylphenyl)sulfonylfuran-2-carboxamide is Cc1cccc(S(=O)(=O)NC(=O)c2ccco2)c1.
What is the InChIKey of N-(3-methylphenyl)sulfonylfuran-2-carboxamide?
The InChIKey is FJFJJSOEOQSALT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11NO4S/c1-9-4-2-5-10(8-9)18(15,16)13-12(14)11-6-3-7-17-11/h2-8H,1H3,(H,13,14).
What are the key properties of N-(3-methylphenyl)sulfonylfuran-2-carboxamide?
N-(3-methylphenyl)sulfonylfuran-2-carboxamide has a molecular weight of 265.29 g/mol, XLogP of 1.71, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylphenyl)sulfonylfuran-2-carboxamide is sourced from PubChem (CID 47130299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).