N-[[5-(dipropylsulfamoyl)thiophen-2-yl]methyl]acetamide

C13H22N2O3S2 — CID 30963365

IUPACN-[[5-(dipropylsulfamoyl)thiophen-2-yl]methyl]acetamide
SMILESCCCN(CCC)S(=O)(=O)c1ccc(CNC(C)=O)s1
InChIInChI=1S/C13H22N2O3S2/c1-4-8-15(9-5-2)20(17,18)13-7-6-12(19-13)10-14-11(3)16/h6-7H,4-5,8-10H2,1-3H3,(H,14,16)
InChIKeyMGBJYGRHLZKHRQ-UHFFFAOYSA-N
MW318.46 g/mol
LogP2.19
Rot. Bonds8

About N-[[5-(dipropylsulfamoyl)thiophen-2-yl]methyl]acetamide

N-[[5-(dipropylsulfamoyl)thiophen-2-yl]methyl]acetamide (PubChem CID 30963365) has the molecular formula C13H22N2O3S2 and a molecular weight of 318.46 g/mol. Its IUPAC name is N-[[5-(dipropylsulfamoyl)thiophen-2-yl]methyl]acetamide.

Molecular Properties

Compound NameN-[[5-(dipropylsulfamoyl)thiophen-2-yl]methyl]acetamide
PubChem CID30963365
Molecular FormulaC13H22N2O3S2
Molecular Weight318.46 g/mol
Exact Mass318.11
IUPAC NameN-[[5-(dipropylsulfamoyl)thiophen-2-yl]methyl]acetamide
SMILESCCCN(CCC)S(=O)(=O)c1ccc(CNC(C)=O)s1
InChIInChI=1S/C13H22N2O3S2/c1-4-8-15(9-5-2)20(17,18)13-7-6-12(19-13)10-14-11(3)16/h6-7H,4-5,8-10H2,1-3H3,(H,14,16)
InChIKeyMGBJYGRHLZKHRQ-UHFFFAOYSA-N
XLogP2.19
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.46
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[5-[bis(2-methoxyethyl)sulfamoyl]thiophen-2-yl]methyl]acetamide
CID 55364957
N-[[5-[ethyl-(4-fluorophenyl)sulfamoyl]thiophen-2-yl]methyl]acetamide
CID 55384100
N-[[5-[ethyl(oxolan-3-ylmethyl)sulfamoyl]thiophen-2-yl]methyl]acetamide
CID 51097870
N-[[5-(diethylsulfamoyl)thiophen-2-yl]methyl]-N'-methylpyrrolidine-1-carboximidamide
CID 119114598
N-[[5-[2-(4-chlorophenoxy)ethyl-methylsulfamoyl]thiophen-2-yl]methyl]acetamide
CID 39793693
N-[[5-[(4-methoxyphenyl)methyl-methylsulfamoyl]thiophen-2-yl]methyl]acetamide
CID 55353278
5-(2-aminoethyl)-N,N-dibutylthiophene-2-sulfonamide
CID 43520957
N-[[5-(diethylsulfamoyl)thiophen-2-yl]methyl]-N',4-dimethylpiperidine-1-carboximidamide;hydroiodide
CID 119130815
1-[[5-(dimethylsulfamoyl)thiophen-2-yl]methyl]-3-methylurea
CID 47132005
N-[[5-[(2-amino-2-methylpropyl)sulfamoyl]thiophen-2-yl]methyl]acetamide;hydrochloride
CID 119988458
N-[[5-[(4-methylphenyl)sulfamoyl]thiophen-2-yl]methyl]acetamide
CID 16553822
N-[[4-[2-hydroxyethyl(propyl)sulfamoyl]phenyl]methyl]acetamide
CID 61425416

Frequently Asked Questions

What is the IUPAC name of N-[[5-(dipropylsulfamoyl)thiophen-2-yl]methyl]acetamide?
The IUPAC name of N-[[5-(dipropylsulfamoyl)thiophen-2-yl]methyl]acetamide (CID 30963365) is N-[[5-(dipropylsulfamoyl)thiophen-2-yl]methyl]acetamide.
What is the SMILES notation for N-[[5-(dipropylsulfamoyl)thiophen-2-yl]methyl]acetamide?
The canonical SMILES for N-[[5-(dipropylsulfamoyl)thiophen-2-yl]methyl]acetamide is CCCN(CCC)S(=O)(=O)c1ccc(CNC(C)=O)s1.
What is the InChIKey of N-[[5-(dipropylsulfamoyl)thiophen-2-yl]methyl]acetamide?
The InChIKey is MGBJYGRHLZKHRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O3S2/c1-4-8-15(9-5-2)20(17,18)13-7-6-12(19-13)10-14-11(3)16/h6-7H,4-5,8-10H2,1-3H3,(H,14,16).
What are the key properties of N-[[5-(dipropylsulfamoyl)thiophen-2-yl]methyl]acetamide?
N-[[5-(dipropylsulfamoyl)thiophen-2-yl]methyl]acetamide has a molecular weight of 318.46 g/mol, XLogP of 2.19, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(dipropylsulfamoyl)thiophen-2-yl]methyl]acetamide is sourced from PubChem (CID 30963365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).