2-(2-chlorophenoxy)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)acetamide

C18H21ClN2O3S — CID 17011586

IUPAC2-(2-chlorophenoxy)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)acetamide
SMILESO=C(COc1ccccc1Cl)NCC(c1cccs1)N1CCOCC1
InChIInChI=1S/C18H21ClN2O3S/c19-14-4-1-2-5-16(14)24-13-18(22)20-12-15(17-6-3-11-25-17)21-7-9-23-10-8-21/h1-6,11,15H,7-10,12-13H2,(H,20,22)
InChIKeyJSUCIRNWQLBONN-UHFFFAOYSA-N
MW380.90 g/mol
LogP2.97
Rot. Bonds7

About 2-(2-chlorophenoxy)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)acetamide

2-(2-chlorophenoxy)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)acetamide (PubChem CID 17011586) has the molecular formula C18H21ClN2O3S and a molecular weight of 380.90 g/mol. Its IUPAC name is 2-(2-chlorophenoxy)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)acetamide.

Molecular Properties

Compound Name2-(2-chlorophenoxy)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)acetamide
PubChem CID17011586
Molecular FormulaC18H21ClN2O3S
Molecular Weight380.90 g/mol
Exact Mass380.10
IUPAC Name2-(2-chlorophenoxy)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)acetamide
SMILESO=C(COc1ccccc1Cl)NCC(c1cccs1)N1CCOCC1
InChIInChI=1S/C18H21ClN2O3S/c19-14-4-1-2-5-16(14)24-13-18(22)20-12-15(17-6-3-11-25-17)21-7-9-23-10-8-21/h1-6,11,15H,7-10,12-13H2,(H,20,22)
InChIKeyJSUCIRNWQLBONN-UHFFFAOYSA-N
XLogP2.97
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.90
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenoxy)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)acetamide?
The IUPAC name of 2-(2-chlorophenoxy)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)acetamide (CID 17011586) is 2-(2-chlorophenoxy)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)acetamide.
What is the SMILES notation for 2-(2-chlorophenoxy)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)acetamide?
The canonical SMILES for 2-(2-chlorophenoxy)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)acetamide is O=C(COc1ccccc1Cl)NCC(c1cccs1)N1CCOCC1.
What is the InChIKey of 2-(2-chlorophenoxy)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)acetamide?
The InChIKey is JSUCIRNWQLBONN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21ClN2O3S/c19-14-4-1-2-5-16(14)24-13-18(22)20-12-15(17-6-3-11-25-17)21-7-9-23-10-8-21/h1-6,11,15H,7-10,12-13H2,(H,20,22).
What are the key properties of 2-(2-chlorophenoxy)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)acetamide?
2-(2-chlorophenoxy)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)acetamide has a molecular weight of 380.90 g/mol, XLogP of 2.97, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenoxy)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)acetamide is sourced from PubChem (CID 17011586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).