N-[2-[(5-ethylthiophen-2-yl)sulfonylamino]ethyl]-N-(2-methoxyphenyl)acetamide

C17H22N2O4S2 — CID 113060514

IUPACN-[2-[(5-ethylthiophen-2-yl)sulfonylamino]ethyl]-N-(2-methoxyphenyl)acetamide
SMILESCCc1ccc(S(=O)(=O)NCCN(C(C)=O)c2ccccc2OC)s1
InChIInChI=1S/C17H22N2O4S2/c1-4-14-9-10-17(24-14)25(21,22)18-11-12-19(13(2)20)15-7-5-6-8-16(15)23-3/h5-10,18H,4,11-12H2,1-3H3
InChIKeyCDZZOBCPJSQVKY-UHFFFAOYSA-N
MW382.51 g/mol
LogP2.65
Rot. Bonds8

About N-[2-[(5-ethylthiophen-2-yl)sulfonylamino]ethyl]-N-(2-methoxyphenyl)acetamide

N-[2-[(5-ethylthiophen-2-yl)sulfonylamino]ethyl]-N-(2-methoxyphenyl)acetamide (PubChem CID 113060514) has the molecular formula C17H22N2O4S2 and a molecular weight of 382.51 g/mol. Its IUPAC name is N-[2-[(5-ethylthiophen-2-yl)sulfonylamino]ethyl]-N-(2-methoxyphenyl)acetamide.

Molecular Properties

Compound NameN-[2-[(5-ethylthiophen-2-yl)sulfonylamino]ethyl]-N-(2-methoxyphenyl)acetamide
PubChem CID113060514
Molecular FormulaC17H22N2O4S2
Molecular Weight382.51 g/mol
Exact Mass382.10
IUPAC NameN-[2-[(5-ethylthiophen-2-yl)sulfonylamino]ethyl]-N-(2-methoxyphenyl)acetamide
SMILESCCc1ccc(S(=O)(=O)NCCN(C(C)=O)c2ccccc2OC)s1
InChIInChI=1S/C17H22N2O4S2/c1-4-14-9-10-17(24-14)25(21,22)18-11-12-19(13(2)20)15-7-5-6-8-16(15)23-3/h5-10,18H,4,11-12H2,1-3H3
InChIKeyCDZZOBCPJSQVKY-UHFFFAOYSA-N
XLogP2.65
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.51
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-[(5-ethylthiophen-2-yl)sulfonylamino]ethyl]-N-(2-methoxyphenyl)acetamide?
The IUPAC name of N-[2-[(5-ethylthiophen-2-yl)sulfonylamino]ethyl]-N-(2-methoxyphenyl)acetamide (CID 113060514) is N-[2-[(5-ethylthiophen-2-yl)sulfonylamino]ethyl]-N-(2-methoxyphenyl)acetamide.
What is the SMILES notation for N-[2-[(5-ethylthiophen-2-yl)sulfonylamino]ethyl]-N-(2-methoxyphenyl)acetamide?
The canonical SMILES for N-[2-[(5-ethylthiophen-2-yl)sulfonylamino]ethyl]-N-(2-methoxyphenyl)acetamide is CCc1ccc(S(=O)(=O)NCCN(C(C)=O)c2ccccc2OC)s1.
What is the InChIKey of N-[2-[(5-ethylthiophen-2-yl)sulfonylamino]ethyl]-N-(2-methoxyphenyl)acetamide?
The InChIKey is CDZZOBCPJSQVKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O4S2/c1-4-14-9-10-17(24-14)25(21,22)18-11-12-19(13(2)20)15-7-5-6-8-16(15)23-3/h5-10,18H,4,11-12H2,1-3H3.
What are the key properties of N-[2-[(5-ethylthiophen-2-yl)sulfonylamino]ethyl]-N-(2-methoxyphenyl)acetamide?
N-[2-[(5-ethylthiophen-2-yl)sulfonylamino]ethyl]-N-(2-methoxyphenyl)acetamide has a molecular weight of 382.51 g/mol, XLogP of 2.65, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(5-ethylthiophen-2-yl)sulfonylamino]ethyl]-N-(2-methoxyphenyl)acetamide is sourced from PubChem (CID 113060514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).