2-[bis(furan-2-ylmethyl)amino]-N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]acetamide

C21H25N3O6S — CID 26603771

IUPAC2-[bis(furan-2-ylmethyl)amino]-N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]acetamide
SMILESCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)CN(Cc1ccco1)Cc1ccco1
InChIInChI=1S/C21H25N3O6S/c1-23(2)31(26,27)18-8-9-20(28-3)19(12-18)22-21(25)15-24(13-16-6-4-10-29-16)14-17-7-5-11-30-17/h4-12H,13-15H2,1-3H3,(H,22,25)
InChIKeyKUZANQRGKKDVFU-UHFFFAOYSA-N
MW447.51 g/mol
LogP2.77
Rot. Bonds10

About 2-[bis(furan-2-ylmethyl)amino]-N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]acetamide

2-[bis(furan-2-ylmethyl)amino]-N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]acetamide (PubChem CID 26603771) has the molecular formula C21H25N3O6S and a molecular weight of 447.51 g/mol. Its IUPAC name is 2-[bis(furan-2-ylmethyl)amino]-N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]acetamide.

Molecular Properties

Compound Name2-[bis(furan-2-ylmethyl)amino]-N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]acetamide
PubChem CID26603771
Molecular FormulaC21H25N3O6S
Molecular Weight447.51 g/mol
Exact Mass447.15
IUPAC Name2-[bis(furan-2-ylmethyl)amino]-N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]acetamide
SMILESCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)CN(Cc1ccco1)Cc1ccco1
InChIInChI=1S/C21H25N3O6S/c1-23(2)31(26,27)18-8-9-20(28-3)19(12-18)22-21(25)15-24(13-16-6-4-10-29-16)14-17-7-5-11-30-17/h4-12H,13-15H2,1-3H3,(H,22,25)
InChIKeyKUZANQRGKKDVFU-UHFFFAOYSA-N
XLogP2.77
TPSA105.23 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds10
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500447.51
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-[4-(dimethylsulfamoyl)phenyl]-2-[furan-2-ylmethyl(methyl)amino]acetamide
CID 9331913
N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-3,3-diphenylpropanamide
CID 26205505
N-(5-chloro-2-methoxyphenyl)-2-[2-cyanoethyl(furan-2-ylmethyl)amino]acetamide
CID 78823068
3-(2,5-dimethoxyphenyl)-N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]propanamide
CID 38016036
methyl 4-[furan-2-ylmethyl(methyl)sulfamoyl]-2-methoxybenzoate
CID 100686080
N-[5-(furan-2-ylmethylsulfamoyl)-2-methoxyphenyl]acetamide
CID 2991258
2-(2-acetamidophenoxy)-N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]acetamide
CID 7873856
2-(2,6-dichlorophenyl)sulfanyl-N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]acetamide
CID 18777757
N-(5-chloro-2-methoxyphenyl)-3-[5-(dimethylsulfamoyl)-2-methoxyphenyl]propanamide
CID 100658824
2-(2-bromophenoxy)-N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]acetamide
CID 4795217
N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-2-[(2-methyl-1-phenylpropyl)amino]acetamide
CID 17406570
[2-[5-(dimethylsulfamoyl)-2-methoxyanilino]-2-oxoethyl] 2-(methylamino)benzoate
CID 7670665

Frequently Asked Questions

What is the IUPAC name of 2-[bis(furan-2-ylmethyl)amino]-N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]acetamide?
The IUPAC name of 2-[bis(furan-2-ylmethyl)amino]-N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]acetamide (CID 26603771) is 2-[bis(furan-2-ylmethyl)amino]-N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]acetamide.
What is the SMILES notation for 2-[bis(furan-2-ylmethyl)amino]-N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]acetamide?
The canonical SMILES for 2-[bis(furan-2-ylmethyl)amino]-N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]acetamide is COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)CN(Cc1ccco1)Cc1ccco1.
What is the InChIKey of 2-[bis(furan-2-ylmethyl)amino]-N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]acetamide?
The InChIKey is KUZANQRGKKDVFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N3O6S/c1-23(2)31(26,27)18-8-9-20(28-3)19(12-18)22-21(25)15-24(13-16-6-4-10-29-16)14-17-7-5-11-30-17/h4-12H,13-15H2,1-3H3,(H,22,25).
What are the key properties of 2-[bis(furan-2-ylmethyl)amino]-N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]acetamide?
2-[bis(furan-2-ylmethyl)amino]-N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]acetamide has a molecular weight of 447.51 g/mol, XLogP of 2.77, 10 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[bis(furan-2-ylmethyl)amino]-N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]acetamide is sourced from PubChem (CID 26603771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).