N-(2-ethyl-6-methylphenyl)-2-(2-phenoxyanilino)acetamide

C23H24N2O2 — CID 9102660

IUPACN-(2-ethyl-6-methylphenyl)-2-(2-phenoxyanilino)acetamide
SMILESCCc1cccc(C)c1NC(=O)CNc1ccccc1Oc1ccccc1
InChIInChI=1S/C23H24N2O2/c1-3-18-11-9-10-17(2)23(18)25-22(26)16-24-20-14-7-8-15-21(20)27-19-12-5-4-6-13-19/h4-15,24H,3,16H2,1-2H3,(H,25,26)
InChIKeyFWYLJOXGYNPWPY-UHFFFAOYSA-N
MW360.46 g/mol
LogP5.40
Rot. Bonds7

About N-(2-ethyl-6-methylphenyl)-2-(2-phenoxyanilino)acetamide

N-(2-ethyl-6-methylphenyl)-2-(2-phenoxyanilino)acetamide (PubChem CID 9102660) has the molecular formula C23H24N2O2 and a molecular weight of 360.46 g/mol. Its IUPAC name is N-(2-ethyl-6-methylphenyl)-2-(2-phenoxyanilino)acetamide.

Molecular Properties

Compound NameN-(2-ethyl-6-methylphenyl)-2-(2-phenoxyanilino)acetamide
PubChem CID9102660
Molecular FormulaC23H24N2O2
Molecular Weight360.46 g/mol
Exact Mass360.18
IUPAC NameN-(2-ethyl-6-methylphenyl)-2-(2-phenoxyanilino)acetamide
SMILESCCc1cccc(C)c1NC(=O)CNc1ccccc1Oc1ccccc1
InChIInChI=1S/C23H24N2O2/c1-3-18-11-9-10-17(2)23(18)25-22(26)16-24-20-14-7-8-15-21(20)27-19-12-5-4-6-13-19/h4-15,24H,3,16H2,1-2H3,(H,25,26)
InChIKeyFWYLJOXGYNPWPY-UHFFFAOYSA-N
XLogP5.40
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500360.46
LogP ≤ 55.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-ethyl-6-methylphenyl)-2-(2-phenoxyanilino)acetamide?
The IUPAC name of N-(2-ethyl-6-methylphenyl)-2-(2-phenoxyanilino)acetamide (CID 9102660) is N-(2-ethyl-6-methylphenyl)-2-(2-phenoxyanilino)acetamide.
What is the SMILES notation for N-(2-ethyl-6-methylphenyl)-2-(2-phenoxyanilino)acetamide?
The canonical SMILES for N-(2-ethyl-6-methylphenyl)-2-(2-phenoxyanilino)acetamide is CCc1cccc(C)c1NC(=O)CNc1ccccc1Oc1ccccc1.
What is the InChIKey of N-(2-ethyl-6-methylphenyl)-2-(2-phenoxyanilino)acetamide?
The InChIKey is FWYLJOXGYNPWPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O2/c1-3-18-11-9-10-17(2)23(18)25-22(26)16-24-20-14-7-8-15-21(20)27-19-12-5-4-6-13-19/h4-15,24H,3,16H2,1-2H3,(H,25,26).
What are the key properties of N-(2-ethyl-6-methylphenyl)-2-(2-phenoxyanilino)acetamide?
N-(2-ethyl-6-methylphenyl)-2-(2-phenoxyanilino)acetamide has a molecular weight of 360.46 g/mol, XLogP of 5.40, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethyl-6-methylphenyl)-2-(2-phenoxyanilino)acetamide is sourced from PubChem (CID 9102660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).