2-(2,5-dimethylphenoxy)-N-(4-morpholin-4-ylphenyl)acetamide

C20H24N2O3 — CID 729609

IUPAC2-(2,5-dimethylphenoxy)-N-(4-morpholin-4-ylphenyl)acetamide
SMILESCc1ccc(C)c(OCC(=O)Nc2ccc(N3CCOCC3)cc2)c1
InChIInChI=1S/C20H24N2O3/c1-15-3-4-16(2)19(13-15)25-14-20(23)21-17-5-7-18(8-6-17)22-9-11-24-12-10-22/h3-8,13H,9-12,14H2,1-2H3,(H,21,23)
InChIKeyUJQUERXWDYJRPN-UHFFFAOYSA-N
MW340.42 g/mol
LogP3.16
Rot. Bonds5

About 2-(2,5-dimethylphenoxy)-N-(4-morpholin-4-ylphenyl)acetamide

2-(2,5-dimethylphenoxy)-N-(4-morpholin-4-ylphenyl)acetamide (PubChem CID 729609) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is 2-(2,5-dimethylphenoxy)-N-(4-morpholin-4-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(2,5-dimethylphenoxy)-N-(4-morpholin-4-ylphenyl)acetamide
PubChem CID729609
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC Name2-(2,5-dimethylphenoxy)-N-(4-morpholin-4-ylphenyl)acetamide
SMILESCc1ccc(C)c(OCC(=O)Nc2ccc(N3CCOCC3)cc2)c1
InChIInChI=1S/C20H24N2O3/c1-15-3-4-16(2)19(13-15)25-14-20(23)21-17-5-7-18(8-6-17)22-9-11-24-12-10-22/h3-8,13H,9-12,14H2,1-2H3,(H,21,23)
InChIKeyUJQUERXWDYJRPN-UHFFFAOYSA-N
XLogP3.16
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylphenoxy)-N-(4-morpholin-4-ylphenyl)acetamide?
The IUPAC name of 2-(2,5-dimethylphenoxy)-N-(4-morpholin-4-ylphenyl)acetamide (CID 729609) is 2-(2,5-dimethylphenoxy)-N-(4-morpholin-4-ylphenyl)acetamide.
What is the SMILES notation for 2-(2,5-dimethylphenoxy)-N-(4-morpholin-4-ylphenyl)acetamide?
The canonical SMILES for 2-(2,5-dimethylphenoxy)-N-(4-morpholin-4-ylphenyl)acetamide is Cc1ccc(C)c(OCC(=O)Nc2ccc(N3CCOCC3)cc2)c1.
What is the InChIKey of 2-(2,5-dimethylphenoxy)-N-(4-morpholin-4-ylphenyl)acetamide?
The InChIKey is UJQUERXWDYJRPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3/c1-15-3-4-16(2)19(13-15)25-14-20(23)21-17-5-7-18(8-6-17)22-9-11-24-12-10-22/h3-8,13H,9-12,14H2,1-2H3,(H,21,23).
What are the key properties of 2-(2,5-dimethylphenoxy)-N-(4-morpholin-4-ylphenyl)acetamide?
2-(2,5-dimethylphenoxy)-N-(4-morpholin-4-ylphenyl)acetamide has a molecular weight of 340.42 g/mol, XLogP of 3.16, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylphenoxy)-N-(4-morpholin-4-ylphenyl)acetamide is sourced from PubChem (CID 729609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).