5-[2,2-bis(furan-2-yl)ethylsulfamoyl]-2-methoxybenzamide

C18H18N2O6S — CID 131703692

IUPAC5-[2,2-bis(furan-2-yl)ethylsulfamoyl]-2-methoxybenzamide
SMILESCOc1ccc(S(=O)(=O)NCC(c2ccco2)c2ccco2)cc1C(N)=O
InChIInChI=1S/C18H18N2O6S/c1-24-15-7-6-12(10-13(15)18(19)21)27(22,23)20-11-14(16-4-2-8-25-16)17-5-3-9-26-17/h2-10,14,20H,11H2,1H3,(H2,19,21)
InChIKeyKRWHFJASPVEWPU-UHFFFAOYSA-N
MW390.42 g/mol
LogP2.09
Rot. Bonds8

About 5-[2,2-bis(furan-2-yl)ethylsulfamoyl]-2-methoxybenzamide

5-[2,2-bis(furan-2-yl)ethylsulfamoyl]-2-methoxybenzamide (PubChem CID 131703692) has the molecular formula C18H18N2O6S and a molecular weight of 390.42 g/mol. Its IUPAC name is 5-[2,2-bis(furan-2-yl)ethylsulfamoyl]-2-methoxybenzamide.

Molecular Properties

Compound Name5-[2,2-bis(furan-2-yl)ethylsulfamoyl]-2-methoxybenzamide
PubChem CID131703692
Molecular FormulaC18H18N2O6S
Molecular Weight390.42 g/mol
Exact Mass390.09
IUPAC Name5-[2,2-bis(furan-2-yl)ethylsulfamoyl]-2-methoxybenzamide
SMILESCOc1ccc(S(=O)(=O)NCC(c2ccco2)c2ccco2)cc1C(N)=O
InChIInChI=1S/C18H18N2O6S/c1-24-15-7-6-12(10-13(15)18(19)21)27(22,23)20-11-14(16-4-2-8-25-16)17-5-3-9-26-17/h2-10,14,20H,11H2,1H3,(H2,19,21)
InChIKeyKRWHFJASPVEWPU-UHFFFAOYSA-N
XLogP2.09
TPSA124.77 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.42
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

5-(furan-2-ylmethylsulfamoyl)-2-methoxybenzamide
CID 34027934
5-[(2-hydroxy-2-methylpropyl)sulfamoyl]-2-methoxybenzamide
CID 65113342
5-[[2-(5-chlorothiophen-2-yl)-2-methoxyethyl]sulfamoyl]-2-methoxybenzamide
CID 91631065
N-[2-(furan-2-yl)-2-methoxyethyl]-4-methoxy-3-methylbenzenesulfonamide
CID 121145624
N-[2,2-bis(furan-2-yl)ethyl]-2-methoxybenzenesulfonamide
CID 131702585
5-(1,3-dihydroxypropan-2-ylsulfamoyl)-2-methoxybenzamide
CID 65314128
5-[(2-chlorophenyl)methylsulfamoyl]-2-methoxybenzamide
CID 34029898
N-[(2S)-2-(4-chlorophenyl)sulfonyl-2-(furan-2-yl)ethyl]-3,4-dimethoxybenzenesulfonamide
CID 41193078
N-[2-(benzenesulfonyl)-2-(furan-2-yl)ethyl]-4-methoxy-3-methylbenzenesulfonamide
CID 18574109
2-ethoxy-5-(2-methylpropylsulfamoyl)benzamide
CID 171134247
5-[[2-(2-hydroxyethoxy)-2-thiophen-2-ylethyl]sulfamoyl]-2-methoxybenzamide
CID 121023366
5-(tert-butylsulfamoyl)-2-methoxybenzamide
CID 42562024

Frequently Asked Questions

What is the IUPAC name of 5-[2,2-bis(furan-2-yl)ethylsulfamoyl]-2-methoxybenzamide?
The IUPAC name of 5-[2,2-bis(furan-2-yl)ethylsulfamoyl]-2-methoxybenzamide (CID 131703692) is 5-[2,2-bis(furan-2-yl)ethylsulfamoyl]-2-methoxybenzamide.
What is the SMILES notation for 5-[2,2-bis(furan-2-yl)ethylsulfamoyl]-2-methoxybenzamide?
The canonical SMILES for 5-[2,2-bis(furan-2-yl)ethylsulfamoyl]-2-methoxybenzamide is COc1ccc(S(=O)(=O)NCC(c2ccco2)c2ccco2)cc1C(N)=O.
What is the InChIKey of 5-[2,2-bis(furan-2-yl)ethylsulfamoyl]-2-methoxybenzamide?
The InChIKey is KRWHFJASPVEWPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O6S/c1-24-15-7-6-12(10-13(15)18(19)21)27(22,23)20-11-14(16-4-2-8-25-16)17-5-3-9-26-17/h2-10,14,20H,11H2,1H3,(H2,19,21).
What are the key properties of 5-[2,2-bis(furan-2-yl)ethylsulfamoyl]-2-methoxybenzamide?
5-[2,2-bis(furan-2-yl)ethylsulfamoyl]-2-methoxybenzamide has a molecular weight of 390.42 g/mol, XLogP of 2.09, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2,2-bis(furan-2-yl)ethylsulfamoyl]-2-methoxybenzamide is sourced from PubChem (CID 131703692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).