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

C19H21N3O3S — CID 18150831

IUPAC2-(2-cyanophenoxy)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)acetamide
SMILESN#Cc1ccccc1OCC(=O)NCC(c1cccs1)N1CCOCC1
InChIInChI=1S/C19H21N3O3S/c20-12-15-4-1-2-5-17(15)25-14-19(23)21-13-16(18-6-3-11-26-18)22-7-9-24-10-8-22/h1-6,11,16H,7-10,13-14H2,(H,21,23)
InChIKeyYUKNIIWOOCPGSX-UHFFFAOYSA-N
MW371.46 g/mol
LogP2.19
Rot. Bonds7

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

2-(2-cyanophenoxy)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)acetamide (PubChem CID 18150831) has the molecular formula C19H21N3O3S and a molecular weight of 371.46 g/mol. Its IUPAC name is 2-(2-cyanophenoxy)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)acetamide.

Molecular Properties

Compound Name2-(2-cyanophenoxy)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)acetamide
PubChem CID18150831
Molecular FormulaC19H21N3O3S
Molecular Weight371.46 g/mol
Exact Mass371.13
IUPAC Name2-(2-cyanophenoxy)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)acetamide
SMILESN#Cc1ccccc1OCC(=O)NCC(c1cccs1)N1CCOCC1
InChIInChI=1S/C19H21N3O3S/c20-12-15-4-1-2-5-17(15)25-14-19(23)21-13-16(18-6-3-11-26-18)22-7-9-24-10-8-22/h1-6,11,16H,7-10,13-14H2,(H,21,23)
InChIKeyYUKNIIWOOCPGSX-UHFFFAOYSA-N
XLogP2.19
TPSA74.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.46
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(2-cyanophenoxy)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)acetamide?
The IUPAC name of 2-(2-cyanophenoxy)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)acetamide (CID 18150831) is 2-(2-cyanophenoxy)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)acetamide.
What is the SMILES notation for 2-(2-cyanophenoxy)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)acetamide?
The canonical SMILES for 2-(2-cyanophenoxy)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)acetamide is N#Cc1ccccc1OCC(=O)NCC(c1cccs1)N1CCOCC1.
What is the InChIKey of 2-(2-cyanophenoxy)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)acetamide?
The InChIKey is YUKNIIWOOCPGSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O3S/c20-12-15-4-1-2-5-17(15)25-14-19(23)21-13-16(18-6-3-11-26-18)22-7-9-24-10-8-22/h1-6,11,16H,7-10,13-14H2,(H,21,23).
What are the key properties of 2-(2-cyanophenoxy)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)acetamide?
2-(2-cyanophenoxy)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)acetamide has a molecular weight of 371.46 g/mol, XLogP of 2.19, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyanophenoxy)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)acetamide is sourced from PubChem (CID 18150831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).