N-(2,6-dimethylphenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide

C16H20N2O3S2 — CID 112996705

IUPACN-(2,6-dimethylphenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide
SMILESCCc1ccc(S(=O)(=O)NCC(=O)Nc2c(C)cccc2C)s1
InChIInChI=1S/C16H20N2O3S2/c1-4-13-8-9-15(22-13)23(20,21)17-10-14(19)18-16-11(2)6-5-7-12(16)3/h5-9,17H,4,10H2,1-3H3,(H,18,19)
InChIKeyOAKQFTJFBRLELK-UHFFFAOYSA-N
MW352.48 g/mol
LogP2.84
Rot. Bonds6

About N-(2,6-dimethylphenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide

N-(2,6-dimethylphenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide (PubChem CID 112996705) has the molecular formula C16H20N2O3S2 and a molecular weight of 352.48 g/mol. Its IUPAC name is N-(2,6-dimethylphenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide.

Molecular Properties

Compound NameN-(2,6-dimethylphenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide
PubChem CID112996705
Molecular FormulaC16H20N2O3S2
Molecular Weight352.48 g/mol
Exact Mass352.09
IUPAC NameN-(2,6-dimethylphenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide
SMILESCCc1ccc(S(=O)(=O)NCC(=O)Nc2c(C)cccc2C)s1
InChIInChI=1S/C16H20N2O3S2/c1-4-13-8-9-15(22-13)23(20,21)17-10-14(19)18-16-11(2)6-5-7-12(16)3/h5-9,17H,4,10H2,1-3H3,(H,18,19)
InChIKeyOAKQFTJFBRLELK-UHFFFAOYSA-N
XLogP2.84
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.48
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(5-ethylthiophen-2-yl)sulfonylamino]-N-(4-methylphenyl)acetamide
CID 112996218
2-[(5-ethylthiophen-2-yl)sulfonylamino]-N-(4-fluorophenyl)acetamide
CID 112997718
5-ethyl-N-(2-oxopropyl)thiophene-2-sulfonamide
CID 64994375
N-(3,5-dichlorophenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide
CID 113001388
2-[(5-ethylthiophen-2-yl)sulfonylamino]-N-[(3-methylphenyl)methyl]acetamide
CID 112992219
5-ethyl-N-phenacylthiophene-2-sulfonamide
CID 64993884
N-(3,4-dimethoxyphenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide
CID 112999325
5-ethyl-N-(2-methylprop-2-enyl)thiophene-2-sulfonamide
CID 114616513
N-(2,6-difluorophenyl)-2-[(5-methylthiophen-2-yl)sulfonylamino]acetamide
CID 113002331
2-[(5-ethylthiophen-2-yl)sulfonylamino]-N-(pyridin-2-ylmethyl)acetamide
CID 112993027
N-(2-ethyl-6-methylphenyl)-2-[(2-methylphenyl)sulfonylamino]acetamide
CID 112997077
2-[5-[[2-(ethylamino)-2-oxoethyl]sulfamoyl]thiophen-2-yl]acetic acid
CID 43401345

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethylphenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide?
The IUPAC name of N-(2,6-dimethylphenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide (CID 112996705) is N-(2,6-dimethylphenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide.
What is the SMILES notation for N-(2,6-dimethylphenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide?
The canonical SMILES for N-(2,6-dimethylphenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide is CCc1ccc(S(=O)(=O)NCC(=O)Nc2c(C)cccc2C)s1.
What is the InChIKey of N-(2,6-dimethylphenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide?
The InChIKey is OAKQFTJFBRLELK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O3S2/c1-4-13-8-9-15(22-13)23(20,21)17-10-14(19)18-16-11(2)6-5-7-12(16)3/h5-9,17H,4,10H2,1-3H3,(H,18,19).
What are the key properties of N-(2,6-dimethylphenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide?
N-(2,6-dimethylphenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide has a molecular weight of 352.48 g/mol, XLogP of 2.84, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethylphenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide is sourced from PubChem (CID 112996705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).