2-(2-benzylphenoxy)-N-(5-methyl-2-pyridinyl)acetamide

C21H20N2O2 — CID 60521789

IUPAC2-(2-benzylphenoxy)-N-(5-methyl-2-pyridinyl)acetamide
SMILESCc1ccc(NC(=O)COc2ccccc2Cc2ccccc2)nc1
InChIInChI=1S/C21H20N2O2/c1-16-11-12-20(22-14-16)23-21(24)15-25-19-10-6-5-9-18(19)13-17-7-3-2-4-8-17/h2-12,14H,13,15H2,1H3,(H,22,23,24)
InChIKeyWIQSMNGSMSMMSK-UHFFFAOYSA-N
MW332.40 g/mol
LogP4.00
Rot. Bonds6

About 2-(2-benzylphenoxy)-N-(5-methyl-2-pyridinyl)acetamide

2-(2-benzylphenoxy)-N-(5-methyl-2-pyridinyl)acetamide (PubChem CID 60521789) has the molecular formula C21H20N2O2 and a molecular weight of 332.40 g/mol. Its IUPAC name is 2-(2-benzylphenoxy)-N-(5-methyl-2-pyridinyl)acetamide.

Molecular Properties

Compound Name2-(2-benzylphenoxy)-N-(5-methyl-2-pyridinyl)acetamide
PubChem CID60521789
Molecular FormulaC21H20N2O2
Molecular Weight332.40 g/mol
Exact Mass332.15
IUPAC Name2-(2-benzylphenoxy)-N-(5-methyl-2-pyridinyl)acetamide
SMILESCc1ccc(NC(=O)COc2ccccc2Cc2ccccc2)nc1
InChIInChI=1S/C21H20N2O2/c1-16-11-12-20(22-14-16)23-21(24)15-25-19-10-6-5-9-18(19)13-17-7-3-2-4-8-17/h2-12,14H,13,15H2,1H3,(H,22,23,24)
InChIKeyWIQSMNGSMSMMSK-UHFFFAOYSA-N
XLogP4.00
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.40
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(2-benzylphenoxy)-N-(5-methyl-2-pyridinyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(2-benzylphenoxy)-N-(5-methyl-2-pyridinyl)acetamide?
The IUPAC name of 2-(2-benzylphenoxy)-N-(5-methyl-2-pyridinyl)acetamide (CID 60521789) is 2-(2-benzylphenoxy)-N-(5-methyl-2-pyridinyl)acetamide.
What is the SMILES notation for 2-(2-benzylphenoxy)-N-(5-methyl-2-pyridinyl)acetamide?
The canonical SMILES for 2-(2-benzylphenoxy)-N-(5-methyl-2-pyridinyl)acetamide is Cc1ccc(NC(=O)COc2ccccc2Cc2ccccc2)nc1.
What is the InChIKey of 2-(2-benzylphenoxy)-N-(5-methyl-2-pyridinyl)acetamide?
The InChIKey is WIQSMNGSMSMMSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O2/c1-16-11-12-20(22-14-16)23-21(24)15-25-19-10-6-5-9-18(19)13-17-7-3-2-4-8-17/h2-12,14H,13,15H2,1H3,(H,22,23,24).
What are the key properties of 2-(2-benzylphenoxy)-N-(5-methyl-2-pyridinyl)acetamide?
2-(2-benzylphenoxy)-N-(5-methyl-2-pyridinyl)acetamide has a molecular weight of 332.40 g/mol, XLogP of 4.00, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-benzylphenoxy)-N-(5-methyl-2-pyridinyl)acetamide is sourced from PubChem (CID 60521789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).