5-(tert-butylsulfamoyl)-N-methyl-N-(4-phenoxyphenyl)furan-2-carboxamide

C22H24N2O5S — CID 47085584

IUPAC5-(tert-butylsulfamoyl)-N-methyl-N-(4-phenoxyphenyl)furan-2-carboxamide
SMILESCN(C(=O)c1ccc(S(=O)(=O)NC(C)(C)C)o1)c1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C22H24N2O5S/c1-22(2,3)23-30(26,27)20-15-14-19(29-20)21(25)24(4)16-10-12-18(13-11-16)28-17-8-6-5-7-9-17/h5-15,23H,1-4H3
InChIKeyZZXGEOBMLBNHAI-UHFFFAOYSA-N
MW428.51 g/mol
LogP4.43
Rot. Bonds6

About 5-(tert-butylsulfamoyl)-N-methyl-N-(4-phenoxyphenyl)furan-2-carboxamide

5-(tert-butylsulfamoyl)-N-methyl-N-(4-phenoxyphenyl)furan-2-carboxamide (PubChem CID 47085584) has the molecular formula C22H24N2O5S and a molecular weight of 428.51 g/mol. Its IUPAC name is 5-(tert-butylsulfamoyl)-N-methyl-N-(4-phenoxyphenyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-(tert-butylsulfamoyl)-N-methyl-N-(4-phenoxyphenyl)furan-2-carboxamide
PubChem CID47085584
Molecular FormulaC22H24N2O5S
Molecular Weight428.51 g/mol
Exact Mass428.14
IUPAC Name5-(tert-butylsulfamoyl)-N-methyl-N-(4-phenoxyphenyl)furan-2-carboxamide
SMILESCN(C(=O)c1ccc(S(=O)(=O)NC(C)(C)C)o1)c1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C22H24N2O5S/c1-22(2,3)23-30(26,27)20-15-14-19(29-20)21(25)24(4)16-10-12-18(13-11-16)28-17-8-6-5-7-9-17/h5-15,23H,1-4H3
InChIKeyZZXGEOBMLBNHAI-UHFFFAOYSA-N
XLogP4.43
TPSA88.85 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500428.51
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-[(2-fluorophenyl)sulfamoyl]phenyl]furan-2-carboxamide
CID 4597423
N-{4-[(2,6-dimethylmorpholin-4-yl)sulfonyl]phenyl}furan-2-carboxamide
CID 649025
Furan-2-carboxylic acid (tert-butylcarbamoyl-methyl)-(4-ethoxy-phenyl)-amide
CID 646588
N-{4-[(Furan-2-ylmethyl)-sulfamoyl]-phenyl}-2-phenoxy-acetamide
CID 652012
2-[(2-Benzenesulfonylamino-acetyl)-(2-methoxy-phenyl)-amino]-pentanoic acid (furan-2-ylmethyl)-amide
CID 652019
2-[(2-Benzenesulfonylamino-acetyl)-(2-methoxy-phenyl)-amino]-N-furan-2-ylmethyl-3-methyl-butyramide
CID 655807
N-[4-(1-azepanylsulfonyl)phenyl]-2-furamide
CID 671037
4-fluoro-N-(2-furoyl)-N-(4-methoxyphenyl)benzenesulfonamide
CID 993463
N-[4-[ethyl(phenyl)sulfamoyl]phenyl]furan-2-carboxamide
CID 1015406
Furan-2-carboxylic acid (4-benzenesulfonylamino-2,5-diethoxy-phenyl)-amide
CID 1138785
N-[4-[methyl(phenyl)sulfamoyl]phenyl]furan-2-carboxamide
CID 1244950
5-bromo-N-(4-{[cyclohexyl(methyl)amino]sulfonyl}phenyl)-2-furamide
CID 1266786

Frequently Asked Questions

What is the IUPAC name of 5-(tert-butylsulfamoyl)-N-methyl-N-(4-phenoxyphenyl)furan-2-carboxamide?
The IUPAC name of 5-(tert-butylsulfamoyl)-N-methyl-N-(4-phenoxyphenyl)furan-2-carboxamide (CID 47085584) is 5-(tert-butylsulfamoyl)-N-methyl-N-(4-phenoxyphenyl)furan-2-carboxamide.
What is the SMILES notation for 5-(tert-butylsulfamoyl)-N-methyl-N-(4-phenoxyphenyl)furan-2-carboxamide?
The canonical SMILES for 5-(tert-butylsulfamoyl)-N-methyl-N-(4-phenoxyphenyl)furan-2-carboxamide is CN(C(=O)c1ccc(S(=O)(=O)NC(C)(C)C)o1)c1ccc(Oc2ccccc2)cc1.
What is the InChIKey of 5-(tert-butylsulfamoyl)-N-methyl-N-(4-phenoxyphenyl)furan-2-carboxamide?
The InChIKey is ZZXGEOBMLBNHAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O5S/c1-22(2,3)23-30(26,27)20-15-14-19(29-20)21(25)24(4)16-10-12-18(13-11-16)28-17-8-6-5-7-9-17/h5-15,23H,1-4H3.
What are the key properties of 5-(tert-butylsulfamoyl)-N-methyl-N-(4-phenoxyphenyl)furan-2-carboxamide?
5-(tert-butylsulfamoyl)-N-methyl-N-(4-phenoxyphenyl)furan-2-carboxamide has a molecular weight of 428.51 g/mol, XLogP of 4.43, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(tert-butylsulfamoyl)-N-methyl-N-(4-phenoxyphenyl)furan-2-carboxamide is sourced from PubChem (CID 47085584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).