2-(2,3-dimethylphenoxy)-N-(5-methyl-2-pyridinyl)acetamide

C16H18N2O2 — CID 35022382

IUPAC2-(2,3-dimethylphenoxy)-N-(5-methyl-2-pyridinyl)acetamide
SMILESCc1ccc(NC(=O)COc2cccc(C)c2C)nc1
InChIInChI=1S/C16H18N2O2/c1-11-7-8-15(17-9-11)18-16(19)10-20-14-6-4-5-12(2)13(14)3/h4-9H,10H2,1-3H3,(H,17,18,19)
InChIKeyZSSDIENVOUFCSU-UHFFFAOYSA-N
MW270.33 g/mol
LogP3.02
Rot. Bonds4

About 2-(2,3-dimethylphenoxy)-N-(5-methyl-2-pyridinyl)acetamide

2-(2,3-dimethylphenoxy)-N-(5-methyl-2-pyridinyl)acetamide (PubChem CID 35022382) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is 2-(2,3-dimethylphenoxy)-N-(5-methyl-2-pyridinyl)acetamide.

Molecular Properties

Compound Name2-(2,3-dimethylphenoxy)-N-(5-methyl-2-pyridinyl)acetamide
PubChem CID35022382
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC Name2-(2,3-dimethylphenoxy)-N-(5-methyl-2-pyridinyl)acetamide
SMILESCc1ccc(NC(=O)COc2cccc(C)c2C)nc1
InChIInChI=1S/C16H18N2O2/c1-11-7-8-15(17-9-11)18-16(19)10-20-14-6-4-5-12(2)13(14)3/h4-9H,10H2,1-3H3,(H,17,18,19)
InChIKeyZSSDIENVOUFCSU-UHFFFAOYSA-N
XLogP3.02
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dimethylphenoxy)-N-(5-methyl-2-pyridinyl)acetamide?
The IUPAC name of 2-(2,3-dimethylphenoxy)-N-(5-methyl-2-pyridinyl)acetamide (CID 35022382) is 2-(2,3-dimethylphenoxy)-N-(5-methyl-2-pyridinyl)acetamide.
What is the SMILES notation for 2-(2,3-dimethylphenoxy)-N-(5-methyl-2-pyridinyl)acetamide?
The canonical SMILES for 2-(2,3-dimethylphenoxy)-N-(5-methyl-2-pyridinyl)acetamide is Cc1ccc(NC(=O)COc2cccc(C)c2C)nc1.
What is the InChIKey of 2-(2,3-dimethylphenoxy)-N-(5-methyl-2-pyridinyl)acetamide?
The InChIKey is ZSSDIENVOUFCSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-11-7-8-15(17-9-11)18-16(19)10-20-14-6-4-5-12(2)13(14)3/h4-9H,10H2,1-3H3,(H,17,18,19).
What are the key properties of 2-(2,3-dimethylphenoxy)-N-(5-methyl-2-pyridinyl)acetamide?
2-(2,3-dimethylphenoxy)-N-(5-methyl-2-pyridinyl)acetamide has a molecular weight of 270.33 g/mol, XLogP of 3.02, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dimethylphenoxy)-N-(5-methyl-2-pyridinyl)acetamide is sourced from PubChem (CID 35022382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).