N-(3,4-dimethoxyphenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide

C16H20N2O5S2 — CID 112999325

IUPACN-(3,4-dimethoxyphenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide
SMILESCCc1ccc(S(=O)(=O)NCC(=O)Nc2ccc(OC)c(OC)c2)s1
InChIInChI=1S/C16H20N2O5S2/c1-4-12-6-8-16(24-12)25(20,21)17-10-15(19)18-11-5-7-13(22-2)14(9-11)23-3/h5-9,17H,4,10H2,1-3H3,(H,18,19)
InChIKeyPOCPMASYVCAOJX-UHFFFAOYSA-N
MW384.48 g/mol
LogP2.24
Rot. Bonds8

About N-(3,4-dimethoxyphenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide

N-(3,4-dimethoxyphenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide (PubChem CID 112999325) has the molecular formula C16H20N2O5S2 and a molecular weight of 384.48 g/mol. Its IUPAC name is N-(3,4-dimethoxyphenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide.

Molecular Properties

Compound NameN-(3,4-dimethoxyphenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide
PubChem CID112999325
Molecular FormulaC16H20N2O5S2
Molecular Weight384.48 g/mol
Exact Mass384.08
IUPAC NameN-(3,4-dimethoxyphenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide
SMILESCCc1ccc(S(=O)(=O)NCC(=O)Nc2ccc(OC)c(OC)c2)s1
InChIInChI=1S/C16H20N2O5S2/c1-4-12-6-8-16(24-12)25(20,21)17-10-15(19)18-11-5-7-13(22-2)14(9-11)23-3/h5-9,17H,4,10H2,1-3H3,(H,18,19)
InChIKeyPOCPMASYVCAOJX-UHFFFAOYSA-N
XLogP2.24
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.48
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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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
N-(3,5-dichlorophenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide
CID 113001388
N-(3,4-dimethoxyphenyl)-2-[(4-ethoxyphenyl)sulfonylamino]acetamide
CID 112999332
N-(3,4-dimethoxyphenyl)-2-[(2-methylphenyl)sulfonylamino]acetamide
CID 112999333
N-(2,6-dimethylphenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide
CID 112996705
N-[[5-[(3,4-dimethoxyphenyl)sulfamoyl]thiophen-2-yl]methyl]acetamide
CID 16553867
5-ethyl-N-(2-oxopropyl)thiophene-2-sulfonamide
CID 64994375
2-[(5-chlorothiophen-2-yl)sulfonylamino]-N-(4-methoxyphenyl)acetamide
CID 112998754
N,N'-bis(3,4-dimethoxyphenyl)propanediamide
CID 21232287
N-(3,4-dimethoxyphenyl)-2-(4-ethylanilino)acetamide
CID 37465407
2-[(4-carbamimidoylphenyl)sulfonylamino]-N-(3,4-dimethoxyphenyl)acetamide
CID 71449633

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethoxyphenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide?
The IUPAC name of N-(3,4-dimethoxyphenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide (CID 112999325) is N-(3,4-dimethoxyphenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide.
What is the SMILES notation for N-(3,4-dimethoxyphenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide?
The canonical SMILES for N-(3,4-dimethoxyphenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide is CCc1ccc(S(=O)(=O)NCC(=O)Nc2ccc(OC)c(OC)c2)s1.
What is the InChIKey of N-(3,4-dimethoxyphenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide?
The InChIKey is POCPMASYVCAOJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O5S2/c1-4-12-6-8-16(24-12)25(20,21)17-10-15(19)18-11-5-7-13(22-2)14(9-11)23-3/h5-9,17H,4,10H2,1-3H3,(H,18,19).
What are the key properties of N-(3,4-dimethoxyphenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide?
N-(3,4-dimethoxyphenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide has a molecular weight of 384.48 g/mol, XLogP of 2.24, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethoxyphenyl)-2-[(5-ethylthiophen-2-yl)sulfonylamino]acetamide is sourced from PubChem (CID 112999325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).