2-(2,6-dimethylanilino)-N-(2-morpholin-4-ylphenyl)acetamide

C20H25N3O2 — CID 109007545

IUPAC2-(2,6-dimethylanilino)-N-(2-morpholin-4-ylphenyl)acetamide
SMILESCc1cccc(C)c1NCC(=O)Nc1ccccc1N1CCOCC1
InChIInChI=1S/C20H25N3O2/c1-15-6-5-7-16(2)20(15)21-14-19(24)22-17-8-3-4-9-18(17)23-10-12-25-13-11-23/h3-9,21H,10-14H2,1-2H3,(H,22,24)
InChIKeyXENBRZBTEOVRRO-UHFFFAOYSA-N
MW339.44 g/mol
LogP3.19
Rot. Bonds5

About 2-(2,6-dimethylanilino)-N-(2-morpholin-4-ylphenyl)acetamide

2-(2,6-dimethylanilino)-N-(2-morpholin-4-ylphenyl)acetamide (PubChem CID 109007545) has the molecular formula C20H25N3O2 and a molecular weight of 339.44 g/mol. Its IUPAC name is 2-(2,6-dimethylanilino)-N-(2-morpholin-4-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(2,6-dimethylanilino)-N-(2-morpholin-4-ylphenyl)acetamide
PubChem CID109007545
Molecular FormulaC20H25N3O2
Molecular Weight339.44 g/mol
Exact Mass339.19
IUPAC Name2-(2,6-dimethylanilino)-N-(2-morpholin-4-ylphenyl)acetamide
SMILESCc1cccc(C)c1NCC(=O)Nc1ccccc1N1CCOCC1
InChIInChI=1S/C20H25N3O2/c1-15-6-5-7-16(2)20(15)21-14-19(24)22-17-8-3-4-9-18(17)23-10-12-25-13-11-23/h3-9,21H,10-14H2,1-2H3,(H,22,24)
InChIKeyXENBRZBTEOVRRO-UHFFFAOYSA-N
XLogP3.19
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dimethylanilino)-N-(2-morpholin-4-ylphenyl)acetamide?
The IUPAC name of 2-(2,6-dimethylanilino)-N-(2-morpholin-4-ylphenyl)acetamide (CID 109007545) is 2-(2,6-dimethylanilino)-N-(2-morpholin-4-ylphenyl)acetamide.
What is the SMILES notation for 2-(2,6-dimethylanilino)-N-(2-morpholin-4-ylphenyl)acetamide?
The canonical SMILES for 2-(2,6-dimethylanilino)-N-(2-morpholin-4-ylphenyl)acetamide is Cc1cccc(C)c1NCC(=O)Nc1ccccc1N1CCOCC1.
What is the InChIKey of 2-(2,6-dimethylanilino)-N-(2-morpholin-4-ylphenyl)acetamide?
The InChIKey is XENBRZBTEOVRRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O2/c1-15-6-5-7-16(2)20(15)21-14-19(24)22-17-8-3-4-9-18(17)23-10-12-25-13-11-23/h3-9,21H,10-14H2,1-2H3,(H,22,24).
What are the key properties of 2-(2,6-dimethylanilino)-N-(2-morpholin-4-ylphenyl)acetamide?
2-(2,6-dimethylanilino)-N-(2-morpholin-4-ylphenyl)acetamide has a molecular weight of 339.44 g/mol, XLogP of 3.19, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dimethylanilino)-N-(2-morpholin-4-ylphenyl)acetamide is sourced from PubChem (CID 109007545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).