2-(5-chloro-2-methoxyanilino)-N-(2-phenylphenyl)acetamide

C21H19ClN2O2 — CID 26417328

IUPAC2-(5-chloro-2-methoxyanilino)-N-(2-phenylphenyl)acetamide
SMILESCOc1ccc(Cl)cc1NCC(=O)Nc1ccccc1-c1ccccc1
InChIInChI=1S/C21H19ClN2O2/c1-26-20-12-11-16(22)13-19(20)23-14-21(25)24-18-10-6-5-9-17(18)15-7-3-2-4-8-15/h2-13,23H,14H2,1H3,(H,24,25)
InChIKeyLGZZPRZBDKWMMQ-UHFFFAOYSA-N
MW366.85 g/mol
LogP5.07
Rot. Bonds6

About 2-(5-chloro-2-methoxyanilino)-N-(2-phenylphenyl)acetamide

2-(5-chloro-2-methoxyanilino)-N-(2-phenylphenyl)acetamide (PubChem CID 26417328) has the molecular formula C21H19ClN2O2 and a molecular weight of 366.85 g/mol. Its IUPAC name is 2-(5-chloro-2-methoxyanilino)-N-(2-phenylphenyl)acetamide.

Molecular Properties

Compound Name2-(5-chloro-2-methoxyanilino)-N-(2-phenylphenyl)acetamide
PubChem CID26417328
Molecular FormulaC21H19ClN2O2
Molecular Weight366.85 g/mol
Exact Mass366.11
IUPAC Name2-(5-chloro-2-methoxyanilino)-N-(2-phenylphenyl)acetamide
SMILESCOc1ccc(Cl)cc1NCC(=O)Nc1ccccc1-c1ccccc1
InChIInChI=1S/C21H19ClN2O2/c1-26-20-12-11-16(22)13-19(20)23-14-21(25)24-18-10-6-5-9-17(18)15-7-3-2-4-8-15/h2-13,23H,14H2,1H3,(H,24,25)
InChIKeyLGZZPRZBDKWMMQ-UHFFFAOYSA-N
XLogP5.07
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.85
LogP ≤ 55.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(5-chloro-2-methoxyanilino)-N-(2-phenylphenyl)acetamide?
The IUPAC name of 2-(5-chloro-2-methoxyanilino)-N-(2-phenylphenyl)acetamide (CID 26417328) is 2-(5-chloro-2-methoxyanilino)-N-(2-phenylphenyl)acetamide.
What is the SMILES notation for 2-(5-chloro-2-methoxyanilino)-N-(2-phenylphenyl)acetamide?
The canonical SMILES for 2-(5-chloro-2-methoxyanilino)-N-(2-phenylphenyl)acetamide is COc1ccc(Cl)cc1NCC(=O)Nc1ccccc1-c1ccccc1.
What is the InChIKey of 2-(5-chloro-2-methoxyanilino)-N-(2-phenylphenyl)acetamide?
The InChIKey is LGZZPRZBDKWMMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19ClN2O2/c1-26-20-12-11-16(22)13-19(20)23-14-21(25)24-18-10-6-5-9-17(18)15-7-3-2-4-8-15/h2-13,23H,14H2,1H3,(H,24,25).
What are the key properties of 2-(5-chloro-2-methoxyanilino)-N-(2-phenylphenyl)acetamide?
2-(5-chloro-2-methoxyanilino)-N-(2-phenylphenyl)acetamide has a molecular weight of 366.85 g/mol, XLogP of 5.07, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloro-2-methoxyanilino)-N-(2-phenylphenyl)acetamide is sourced from PubChem (CID 26417328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).