2-(4-chloro-3-ethylphenoxy)-N-(2,5-dimethylphenyl)acetamide

C18H20ClNO2 — CID 7642630

IUPAC2-(4-chloro-3-ethylphenoxy)-N-(2,5-dimethylphenyl)acetamide
SMILESCCc1cc(OCC(=O)Nc2cc(C)ccc2C)ccc1Cl
InChIInChI=1S/C18H20ClNO2/c1-4-14-10-15(7-8-16(14)19)22-11-18(21)20-17-9-12(2)5-6-13(17)3/h5-10H,4,11H2,1-3H3,(H,20,21)
InChIKeyJEGNWYQGZAHOLI-UHFFFAOYSA-N
MW317.82 g/mol
LogP4.54
Rot. Bonds5

About 2-(4-chloro-3-ethylphenoxy)-N-(2,5-dimethylphenyl)acetamide

2-(4-chloro-3-ethylphenoxy)-N-(2,5-dimethylphenyl)acetamide (PubChem CID 7642630) has the molecular formula C18H20ClNO2 and a molecular weight of 317.82 g/mol. Its IUPAC name is 2-(4-chloro-3-ethylphenoxy)-N-(2,5-dimethylphenyl)acetamide.

Molecular Properties

Compound Name2-(4-chloro-3-ethylphenoxy)-N-(2,5-dimethylphenyl)acetamide
PubChem CID7642630
Molecular FormulaC18H20ClNO2
Molecular Weight317.82 g/mol
Exact Mass317.12
IUPAC Name2-(4-chloro-3-ethylphenoxy)-N-(2,5-dimethylphenyl)acetamide
SMILESCCc1cc(OCC(=O)Nc2cc(C)ccc2C)ccc1Cl
InChIInChI=1S/C18H20ClNO2/c1-4-14-10-15(7-8-16(14)19)22-11-18(21)20-17-9-12(2)5-6-13(17)3/h5-10H,4,11H2,1-3H3,(H,20,21)
InChIKeyJEGNWYQGZAHOLI-UHFFFAOYSA-N
XLogP4.54
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.82
LogP ≤ 54.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chloro-3-ethylphenoxy)-N-(2,5-dimethylphenyl)acetamide?
The IUPAC name of 2-(4-chloro-3-ethylphenoxy)-N-(2,5-dimethylphenyl)acetamide (CID 7642630) is 2-(4-chloro-3-ethylphenoxy)-N-(2,5-dimethylphenyl)acetamide.
What is the SMILES notation for 2-(4-chloro-3-ethylphenoxy)-N-(2,5-dimethylphenyl)acetamide?
The canonical SMILES for 2-(4-chloro-3-ethylphenoxy)-N-(2,5-dimethylphenyl)acetamide is CCc1cc(OCC(=O)Nc2cc(C)ccc2C)ccc1Cl.
What is the InChIKey of 2-(4-chloro-3-ethylphenoxy)-N-(2,5-dimethylphenyl)acetamide?
The InChIKey is JEGNWYQGZAHOLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20ClNO2/c1-4-14-10-15(7-8-16(14)19)22-11-18(21)20-17-9-12(2)5-6-13(17)3/h5-10H,4,11H2,1-3H3,(H,20,21).
What are the key properties of 2-(4-chloro-3-ethylphenoxy)-N-(2,5-dimethylphenyl)acetamide?
2-(4-chloro-3-ethylphenoxy)-N-(2,5-dimethylphenyl)acetamide has a molecular weight of 317.82 g/mol, XLogP of 4.54, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chloro-3-ethylphenoxy)-N-(2,5-dimethylphenyl)acetamide is sourced from PubChem (CID 7642630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).