N-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]-2,4-dimethoxybenzamide

C16H20N2O5S2 — CID 37017997

IUPACN-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]-2,4-dimethoxybenzamide
SMILESCOc1ccc(C(=O)NCc2ccc(S(=O)(=O)N(C)C)s2)c(OC)c1
InChIInChI=1S/C16H20N2O5S2/c1-18(2)25(20,21)15-8-6-12(24-15)10-17-16(19)13-7-5-11(22-3)9-14(13)23-4/h5-9H,10H2,1-4H3,(H,17,19)
InChIKeyAZBGHHMPRCNFMG-UHFFFAOYSA-N
MW384.48 g/mol
LogP1.95
Rot. Bonds7

About N-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]-2,4-dimethoxybenzamide

N-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]-2,4-dimethoxybenzamide (PubChem CID 37017997) has the molecular formula C16H20N2O5S2 and a molecular weight of 384.48 g/mol. Its IUPAC name is N-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]-2,4-dimethoxybenzamide.

Molecular Properties

Compound NameN-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]-2,4-dimethoxybenzamide
PubChem CID37017997
Molecular FormulaC16H20N2O5S2
Molecular Weight384.48 g/mol
Exact Mass384.08
IUPAC NameN-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]-2,4-dimethoxybenzamide
SMILESCOc1ccc(C(=O)NCc2ccc(S(=O)(=O)N(C)C)s2)c(OC)c1
InChIInChI=1S/C16H20N2O5S2/c1-18(2)25(20,21)15-8-6-12(24-15)10-17-16(19)13-7-5-11(22-3)9-14(13)23-4/h5-9H,10H2,1-4H3,(H,17,19)
InChIKeyAZBGHHMPRCNFMG-UHFFFAOYSA-N
XLogP1.95
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.48
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]-2,4-dimethoxybenzamide?
The IUPAC name of N-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]-2,4-dimethoxybenzamide (CID 37017997) is N-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]-2,4-dimethoxybenzamide.
What is the SMILES notation for N-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]-2,4-dimethoxybenzamide?
The canonical SMILES for N-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]-2,4-dimethoxybenzamide is COc1ccc(C(=O)NCc2ccc(S(=O)(=O)N(C)C)s2)c(OC)c1.
What is the InChIKey of N-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]-2,4-dimethoxybenzamide?
The InChIKey is AZBGHHMPRCNFMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O5S2/c1-18(2)25(20,21)15-8-6-12(24-15)10-17-16(19)13-7-5-11(22-3)9-14(13)23-4/h5-9H,10H2,1-4H3,(H,17,19).
What are the key properties of N-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]-2,4-dimethoxybenzamide?
N-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]-2,4-dimethoxybenzamide has a molecular weight of 384.48 g/mol, XLogP of 1.95, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]-2,4-dimethoxybenzamide is sourced from PubChem (CID 37017997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).