2-(3-methylphenoxy)-N-(3-methylphenyl)acetamide

C16H17NO2 — CID 2787094

IUPAC2-(3-methylphenoxy)-N-(3-methylphenyl)acetamide
SMILESCc1cccc(NC(=O)COc2cccc(C)c2)c1
InChIInChI=1S/C16H17NO2/c1-12-5-3-7-14(9-12)17-16(18)11-19-15-8-4-6-13(2)10-15/h3-10H,11H2,1-2H3,(H,17,18)
InChIKeyWBIGTIFZPFWOTR-UHFFFAOYSA-N
MW255.32 g/mol
LogP3.32
Rot. Bonds4

About 2-(3-methylphenoxy)-N-(3-methylphenyl)acetamide

2-(3-methylphenoxy)-N-(3-methylphenyl)acetamide (PubChem CID 2787094) has the molecular formula C16H17NO2 and a molecular weight of 255.32 g/mol. Its IUPAC name is 2-(3-methylphenoxy)-N-(3-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(3-methylphenoxy)-N-(3-methylphenyl)acetamide
PubChem CID2787094
Molecular FormulaC16H17NO2
Molecular Weight255.32 g/mol
Exact Mass255.13
IUPAC Name2-(3-methylphenoxy)-N-(3-methylphenyl)acetamide
SMILESCc1cccc(NC(=O)COc2cccc(C)c2)c1
InChIInChI=1S/C16H17NO2/c1-12-5-3-7-14(9-12)17-16(18)11-19-15-8-4-6-13(2)10-15/h3-10H,11H2,1-2H3,(H,17,18)
InChIKeyWBIGTIFZPFWOTR-UHFFFAOYSA-N
XLogP3.32
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methylphenoxy)-N-(3-methylphenyl)acetamide?
The IUPAC name of 2-(3-methylphenoxy)-N-(3-methylphenyl)acetamide (CID 2787094) is 2-(3-methylphenoxy)-N-(3-methylphenyl)acetamide.
What is the SMILES notation for 2-(3-methylphenoxy)-N-(3-methylphenyl)acetamide?
The canonical SMILES for 2-(3-methylphenoxy)-N-(3-methylphenyl)acetamide is Cc1cccc(NC(=O)COc2cccc(C)c2)c1.
What is the InChIKey of 2-(3-methylphenoxy)-N-(3-methylphenyl)acetamide?
The InChIKey is WBIGTIFZPFWOTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO2/c1-12-5-3-7-14(9-12)17-16(18)11-19-15-8-4-6-13(2)10-15/h3-10H,11H2,1-2H3,(H,17,18).
What are the key properties of 2-(3-methylphenoxy)-N-(3-methylphenyl)acetamide?
2-(3-methylphenoxy)-N-(3-methylphenyl)acetamide has a molecular weight of 255.32 g/mol, XLogP of 3.32, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylphenoxy)-N-(3-methylphenyl)acetamide is sourced from PubChem (CID 2787094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).