N-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]-2-methoxybenzamide

C15H18N2O4S2 — CID 37017962

IUPACN-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)NCc1ccc(S(=O)(=O)N(C)C)s1
InChIInChI=1S/C15H18N2O4S2/c1-17(2)23(19,20)14-9-8-11(22-14)10-16-15(18)12-6-4-5-7-13(12)21-3/h4-9H,10H2,1-3H3,(H,16,18)
InChIKeyMZVAOJSXSCKCKW-UHFFFAOYSA-N
MW354.45 g/mol
LogP1.94
Rot. Bonds6

About N-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]-2-methoxybenzamide

N-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]-2-methoxybenzamide (PubChem CID 37017962) has the molecular formula C15H18N2O4S2 and a molecular weight of 354.45 g/mol. Its IUPAC name is N-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]-2-methoxybenzamide.

Molecular Properties

Compound NameN-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]-2-methoxybenzamide
PubChem CID37017962
Molecular FormulaC15H18N2O4S2
Molecular Weight354.45 g/mol
Exact Mass354.07
IUPAC NameN-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)NCc1ccc(S(=O)(=O)N(C)C)s1
InChIInChI=1S/C15H18N2O4S2/c1-17(2)23(19,20)14-9-8-11(22-14)10-16-15(18)12-6-4-5-7-13(12)21-3/h4-9H,10H2,1-3H3,(H,16,18)
InChIKeyMZVAOJSXSCKCKW-UHFFFAOYSA-N
XLogP1.94
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.45
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]thiophene-2-carboxamide
CID 33152535
1-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]-3-methylurea
CID 47132005
N-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]-5-(4-fluorophenyl)thiophene-2-carboxamide
CID 33307839
N-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]-2,4-dimethyl-1,3-thiazole-5-carboxamide
CID 53112482
1-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]-3-(2-fluorophenyl)urea
CID 17445044
2-methoxy-N-(2-methylsulfonylethyl)benzamide
CID 47230081
4-(2,5-dimethylpyrrol-1-yl)-N-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]benzamide
CID 33306976
2,6-dimethoxy-N-[(5-phenylthiophen-2-yl)methyl]benzamide
CID 110292490
2-methoxy-N-(1,3-oxazol-4-ylmethyl)benzamide
CID 110718900
1-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]-3-[(1S)-3-methyl-1-phenylbutyl]urea
CID 36520315
(2S)-N-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]-2-(3-methylbutoxy)propanamide
CID 52519602
N-[4-[2-[[5-(dimethylsulfamoyl)thiophen-2-yl]methylamino]-2-oxoethyl]-1,3-thiazol-2-yl]-2-fluorobenzamide
CID 55706981

Frequently Asked Questions

What is the IUPAC name of N-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]-2-methoxybenzamide?
The IUPAC name of N-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]-2-methoxybenzamide (CID 37017962) is N-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]-2-methoxybenzamide.
What is the SMILES notation for N-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]-2-methoxybenzamide?
The canonical SMILES for N-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]-2-methoxybenzamide is COc1ccccc1C(=O)NCc1ccc(S(=O)(=O)N(C)C)s1.
What is the InChIKey of N-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]-2-methoxybenzamide?
The InChIKey is MZVAOJSXSCKCKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O4S2/c1-17(2)23(19,20)14-9-8-11(22-14)10-16-15(18)12-6-4-5-7-13(12)21-3/h4-9H,10H2,1-3H3,(H,16,18).
What are the key properties of N-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]-2-methoxybenzamide?
N-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]-2-methoxybenzamide has a molecular weight of 354.45 g/mol, XLogP of 1.94, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]-2-methoxybenzamide is sourced from PubChem (CID 37017962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).