N-[3-[bis(furan-2-ylmethyl)sulfamoyl]-4-methylphenyl]acetamide

C19H20N2O5S — CID 55365023

IUPACN-[3-[bis(furan-2-ylmethyl)sulfamoyl]-4-methylphenyl]acetamide
SMILESCC(=O)Nc1ccc(C)c(S(=O)(=O)N(Cc2ccco2)Cc2ccco2)c1
InChIInChI=1S/C19H20N2O5S/c1-14-7-8-16(20-15(2)22)11-19(14)27(23,24)21(12-17-5-3-9-25-17)13-18-6-4-10-26-18/h3-11H,12-13H2,1-2H3,(H,20,22)
InChIKeyWKVVJJYOGCLHJP-UHFFFAOYSA-N
MW388.45 g/mol
LogP3.53
Rot. Bonds7

About N-[3-[bis(furan-2-ylmethyl)sulfamoyl]-4-methylphenyl]acetamide

N-[3-[bis(furan-2-ylmethyl)sulfamoyl]-4-methylphenyl]acetamide (PubChem CID 55365023) has the molecular formula C19H20N2O5S and a molecular weight of 388.45 g/mol. Its IUPAC name is N-[3-[bis(furan-2-ylmethyl)sulfamoyl]-4-methylphenyl]acetamide.

Molecular Properties

Compound NameN-[3-[bis(furan-2-ylmethyl)sulfamoyl]-4-methylphenyl]acetamide
PubChem CID55365023
Molecular FormulaC19H20N2O5S
Molecular Weight388.45 g/mol
Exact Mass388.11
IUPAC NameN-[3-[bis(furan-2-ylmethyl)sulfamoyl]-4-methylphenyl]acetamide
SMILESCC(=O)Nc1ccc(C)c(S(=O)(=O)N(Cc2ccco2)Cc2ccco2)c1
InChIInChI=1S/C19H20N2O5S/c1-14-7-8-16(20-15(2)22)11-19(14)27(23,24)21(12-17-5-3-9-25-17)13-18-6-4-10-26-18/h3-11H,12-13H2,1-2H3,(H,20,22)
InChIKeyWKVVJJYOGCLHJP-UHFFFAOYSA-N
XLogP3.53
TPSA92.76 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.45
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-(diethylsulfamoyl)-4-methylphenyl]-2-[furan-2-ylmethyl(methyl)amino]acetamide
CID 9333516
N-[3-(furan-2-ylmethylsulfamoyl)-4-methylphenyl]acetamide
CID 39791883
N-benzyl-N-(furan-2-ylmethyl)-2,5-dimethylbenzenesulfonamide
CID 2563703
N-[3-(diethylsulfamoyl)-4-methylphenyl]-4-(furan-2-ylmethylsulfamoyl)benzamide
CID 5147041
N-[3-[ethyl(2-methylprop-2-enyl)sulfamoyl]-4-methylphenyl]acetamide
CID 39792493
N-[3-[(4-ethylphenyl)methyl-(pyridin-3-ylmethyl)sulfamoyl]-4-methylphenyl]acetamide
CID 55366801
2-[(5-acetamido-2-methylphenyl)sulfonyl-methylamino]acetic acid
CID 60651397
[2-[3-(diethylsulfamoyl)-4-methylanilino]-2-oxoethyl]-[(1S)-1-(furan-2-yl)ethyl]azanium
CID 8917798
2-amino-N-[3-(diethylsulfamoyl)-4-methylphenyl]benzamide
CID 119943661
3-[acetyl(furan-2-ylmethyl)amino]-N-(3,4-dimethylphenyl)propanamide
CID 113118081
N-[5-[[3-(diethylsulfamoyl)-4-methylphenyl]carbamoyl]-4-methylthiophen-2-yl]furan-2-carboxamide
CID 25443607
2-[furan-2-ylmethyl-(3-methylphenyl)sulfonylamino]-N-(4-methylphenyl)acetamide
CID 4787933

Frequently Asked Questions

What is the IUPAC name of N-[3-[bis(furan-2-ylmethyl)sulfamoyl]-4-methylphenyl]acetamide?
The IUPAC name of N-[3-[bis(furan-2-ylmethyl)sulfamoyl]-4-methylphenyl]acetamide (CID 55365023) is N-[3-[bis(furan-2-ylmethyl)sulfamoyl]-4-methylphenyl]acetamide.
What is the SMILES notation for N-[3-[bis(furan-2-ylmethyl)sulfamoyl]-4-methylphenyl]acetamide?
The canonical SMILES for N-[3-[bis(furan-2-ylmethyl)sulfamoyl]-4-methylphenyl]acetamide is CC(=O)Nc1ccc(C)c(S(=O)(=O)N(Cc2ccco2)Cc2ccco2)c1.
What is the InChIKey of N-[3-[bis(furan-2-ylmethyl)sulfamoyl]-4-methylphenyl]acetamide?
The InChIKey is WKVVJJYOGCLHJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O5S/c1-14-7-8-16(20-15(2)22)11-19(14)27(23,24)21(12-17-5-3-9-25-17)13-18-6-4-10-26-18/h3-11H,12-13H2,1-2H3,(H,20,22).
What are the key properties of N-[3-[bis(furan-2-ylmethyl)sulfamoyl]-4-methylphenyl]acetamide?
N-[3-[bis(furan-2-ylmethyl)sulfamoyl]-4-methylphenyl]acetamide has a molecular weight of 388.45 g/mol, XLogP of 3.53, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[bis(furan-2-ylmethyl)sulfamoyl]-4-methylphenyl]acetamide is sourced from PubChem (CID 55365023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).