2-[(5-ethylthiophen-2-yl)sulfonylamino]-N-[(3-methylphenyl)methyl]acetamide

C16H20N2O3S2 — CID 112992219

IUPAC2-[(5-ethylthiophen-2-yl)sulfonylamino]-N-[(3-methylphenyl)methyl]acetamide
SMILESCCc1ccc(S(=O)(=O)NCC(=O)NCc2cccc(C)c2)s1
InChIInChI=1S/C16H20N2O3S2/c1-3-14-7-8-16(22-14)23(20,21)18-11-15(19)17-10-13-6-4-5-12(2)9-13/h4-9,18H,3,10-11H2,1-2H3,(H,17,19)
InChIKeyBYGFKJYKOCENRW-UHFFFAOYSA-N
MW352.48 g/mol
LogP2.21
Rot. Bonds7

About 2-[(5-ethylthiophen-2-yl)sulfonylamino]-N-[(3-methylphenyl)methyl]acetamide

2-[(5-ethylthiophen-2-yl)sulfonylamino]-N-[(3-methylphenyl)methyl]acetamide (PubChem CID 112992219) has the molecular formula C16H20N2O3S2 and a molecular weight of 352.48 g/mol. Its IUPAC name is 2-[(5-ethylthiophen-2-yl)sulfonylamino]-N-[(3-methylphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-[(5-ethylthiophen-2-yl)sulfonylamino]-N-[(3-methylphenyl)methyl]acetamide
PubChem CID112992219
Molecular FormulaC16H20N2O3S2
Molecular Weight352.48 g/mol
Exact Mass352.09
IUPAC Name2-[(5-ethylthiophen-2-yl)sulfonylamino]-N-[(3-methylphenyl)methyl]acetamide
SMILESCCc1ccc(S(=O)(=O)NCC(=O)NCc2cccc(C)c2)s1
InChIInChI=1S/C16H20N2O3S2/c1-3-14-7-8-16(22-14)23(20,21)18-11-15(19)17-10-13-6-4-5-12(2)9-13/h4-9,18H,3,10-11H2,1-2H3,(H,17,19)
InChIKeyBYGFKJYKOCENRW-UHFFFAOYSA-N
XLogP2.21
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.48
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,6-dimethylphenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide
CID 112996705
2-[(5-ethylthiophen-2-yl)sulfonylamino]-N-(pyridin-2-ylmethyl)acetamide
CID 112993027
N-[(3-methylphenyl)methyl]-2-(propylsulfonylamino)acetamide
CID 112992190
2-[(5-ethylthiophen-2-yl)sulfonylamino]-N-(4-methylphenyl)acetamide
CID 112996218
2-[(4-chlorophenyl)sulfonylamino]-N-[(3-methylphenyl)methyl]acetamide
CID 112992196
3-[[(5-ethylthiophen-2-yl)sulfonylamino]methyl]benzoic acid
CID 61454207
2-(butylsulfonylamino)-N-[(3-methylphenyl)methyl]acetamide
CID 112992191
5-(2-aminoethyl)-N-[(3-methylphenyl)methyl]thiophene-2-sulfonamide
CID 60903374
5-ethyl-N-(2-oxopropyl)thiophene-2-sulfonamide
CID 64994375
N-(3,5-dichlorophenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide
CID 113001388
N-[(3-methylphenyl)methyl]-2-(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)acetamide
CID 37430896
2-(methylamino)-N-[(3-methylphenyl)methyl]acetamide
CID 60913954

Frequently Asked Questions

What is the IUPAC name of 2-[(5-ethylthiophen-2-yl)sulfonylamino]-N-[(3-methylphenyl)methyl]acetamide?
The IUPAC name of 2-[(5-ethylthiophen-2-yl)sulfonylamino]-N-[(3-methylphenyl)methyl]acetamide (CID 112992219) is 2-[(5-ethylthiophen-2-yl)sulfonylamino]-N-[(3-methylphenyl)methyl]acetamide.
What is the SMILES notation for 2-[(5-ethylthiophen-2-yl)sulfonylamino]-N-[(3-methylphenyl)methyl]acetamide?
The canonical SMILES for 2-[(5-ethylthiophen-2-yl)sulfonylamino]-N-[(3-methylphenyl)methyl]acetamide is CCc1ccc(S(=O)(=O)NCC(=O)NCc2cccc(C)c2)s1.
What is the InChIKey of 2-[(5-ethylthiophen-2-yl)sulfonylamino]-N-[(3-methylphenyl)methyl]acetamide?
The InChIKey is BYGFKJYKOCENRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O3S2/c1-3-14-7-8-16(22-14)23(20,21)18-11-15(19)17-10-13-6-4-5-12(2)9-13/h4-9,18H,3,10-11H2,1-2H3,(H,17,19).
What are the key properties of 2-[(5-ethylthiophen-2-yl)sulfonylamino]-N-[(3-methylphenyl)methyl]acetamide?
2-[(5-ethylthiophen-2-yl)sulfonylamino]-N-[(3-methylphenyl)methyl]acetamide has a molecular weight of 352.48 g/mol, XLogP of 2.21, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-ethylthiophen-2-yl)sulfonylamino]-N-[(3-methylphenyl)methyl]acetamide is sourced from PubChem (CID 112992219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).