N-[4-methoxy-3-[methyl-[(5-methylfuran-2-yl)methyl]sulfamoyl]phenyl]acetamide

C16H20N2O5S — CID 31391604

IUPACN-[4-methoxy-3-[methyl-[(5-methylfuran-2-yl)methyl]sulfamoyl]phenyl]acetamide
SMILESCOc1ccc(NC(C)=O)cc1S(=O)(=O)N(C)Cc1ccc(C)o1
InChIInChI=1S/C16H20N2O5S/c1-11-5-7-14(23-11)10-18(3)24(20,21)16-9-13(17-12(2)19)6-8-15(16)22-4/h5-9H,10H2,1-4H3,(H,17,19)
InChIKeyQWKMOFODFBHXAU-UHFFFAOYSA-N
MW352.41 g/mol
LogP2.38
Rot. Bonds6

About N-[4-methoxy-3-[methyl-[(5-methylfuran-2-yl)methyl]sulfamoyl]phenyl]acetamide

N-[4-methoxy-3-[methyl-[(5-methylfuran-2-yl)methyl]sulfamoyl]phenyl]acetamide (PubChem CID 31391604) has the molecular formula C16H20N2O5S and a molecular weight of 352.41 g/mol. Its IUPAC name is N-[4-methoxy-3-[methyl-[(5-methylfuran-2-yl)methyl]sulfamoyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-methoxy-3-[methyl-[(5-methylfuran-2-yl)methyl]sulfamoyl]phenyl]acetamide
PubChem CID31391604
Molecular FormulaC16H20N2O5S
Molecular Weight352.41 g/mol
Exact Mass352.11
IUPAC NameN-[4-methoxy-3-[methyl-[(5-methylfuran-2-yl)methyl]sulfamoyl]phenyl]acetamide
SMILESCOc1ccc(NC(C)=O)cc1S(=O)(=O)N(C)Cc1ccc(C)o1
InChIInChI=1S/C16H20N2O5S/c1-11-5-7-14(23-11)10-18(3)24(20,21)16-9-13(17-12(2)19)6-8-15(16)22-4/h5-9H,10H2,1-4H3,(H,17,19)
InChIKeyQWKMOFODFBHXAU-UHFFFAOYSA-N
XLogP2.38
TPSA88.85 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.41
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-[benzyl(methyl)sulfamoyl]-4-methoxyphenyl]acetamide
CID 26945772
N-[4-methoxy-3-[methyl-[(3-methylthiophen-2-yl)methyl]sulfamoyl]phenyl]acetamide
CID 9406654
N-[3-[(2-chlorophenyl)methyl-methylsulfamoyl]-4-methoxyphenyl]acetamide
CID 9320671
N-[3-[cyclohexyl(methyl)sulfamoyl]-4-methoxyphenyl]acetamide
CID 17402561
N-[3-(dimethylsulfamoyl)-4-methoxyphenyl]-3,3-dimethylbutanamide
CID 9109103
3-amino-N,2,5-trimethyl-N-[(5-methylfuran-2-yl)methyl]benzenesulfonamide
CID 79885779
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(2-methoxy-5-methylphenyl)sulfonyl-methylamino]acetamide
CID 1095807
ethyl 4-[[2-[(2,5-dimethoxyphenyl)sulfonyl-methylamino]acetyl]amino]benzoate
CID 45371787
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(2,5-dimethoxyphenyl)sulfonyl-methylamino]acetamide
CID 2219300
N-(4-acetamidophenyl)-2-(N-(2-methoxy-5-methylphenyl)sulfonyl-4-methylanilino)acetamide
CID 126393004
3-amino-N,2-dimethyl-N-[(5-methylfuran-2-yl)methyl]benzenesulfonamide
CID 43526071
2-chloro-N-methyl-N-[(5-methylfuran-2-yl)methyl]benzenesulfonamide
CID 7937794

Frequently Asked Questions

What is the IUPAC name of N-[4-methoxy-3-[methyl-[(5-methylfuran-2-yl)methyl]sulfamoyl]phenyl]acetamide?
The IUPAC name of N-[4-methoxy-3-[methyl-[(5-methylfuran-2-yl)methyl]sulfamoyl]phenyl]acetamide (CID 31391604) is N-[4-methoxy-3-[methyl-[(5-methylfuran-2-yl)methyl]sulfamoyl]phenyl]acetamide.
What is the SMILES notation for N-[4-methoxy-3-[methyl-[(5-methylfuran-2-yl)methyl]sulfamoyl]phenyl]acetamide?
The canonical SMILES for N-[4-methoxy-3-[methyl-[(5-methylfuran-2-yl)methyl]sulfamoyl]phenyl]acetamide is COc1ccc(NC(C)=O)cc1S(=O)(=O)N(C)Cc1ccc(C)o1.
What is the InChIKey of N-[4-methoxy-3-[methyl-[(5-methylfuran-2-yl)methyl]sulfamoyl]phenyl]acetamide?
The InChIKey is QWKMOFODFBHXAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O5S/c1-11-5-7-14(23-11)10-18(3)24(20,21)16-9-13(17-12(2)19)6-8-15(16)22-4/h5-9H,10H2,1-4H3,(H,17,19).
What are the key properties of N-[4-methoxy-3-[methyl-[(5-methylfuran-2-yl)methyl]sulfamoyl]phenyl]acetamide?
N-[4-methoxy-3-[methyl-[(5-methylfuran-2-yl)methyl]sulfamoyl]phenyl]acetamide has a molecular weight of 352.41 g/mol, XLogP of 2.38, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-methoxy-3-[methyl-[(5-methylfuran-2-yl)methyl]sulfamoyl]phenyl]acetamide is sourced from PubChem (CID 31391604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).