2-(4-chloro-3-methylphenoxy)-N-(6-methyl-2-pyridinyl)acetamide

C15H15ClN2O2 — CID 728258

IUPAC2-(4-chloro-3-methylphenoxy)-N-(6-methyl-2-pyridinyl)acetamide
SMILESCc1cccc(NC(=O)COc2ccc(Cl)c(C)c2)n1
InChIInChI=1S/C15H15ClN2O2/c1-10-8-12(6-7-13(10)16)20-9-15(19)18-14-5-3-4-11(2)17-14/h3-8H,9H2,1-2H3,(H,17,18,19)
InChIKeyGQGMHLMNWTXHKP-UHFFFAOYSA-N
MW290.75 g/mol
LogP3.37
Rot. Bonds4

About 2-(4-chloro-3-methylphenoxy)-N-(6-methyl-2-pyridinyl)acetamide

2-(4-chloro-3-methylphenoxy)-N-(6-methyl-2-pyridinyl)acetamide (PubChem CID 728258) has the molecular formula C15H15ClN2O2 and a molecular weight of 290.75 g/mol. Its IUPAC name is 2-(4-chloro-3-methylphenoxy)-N-(6-methyl-2-pyridinyl)acetamide.

Molecular Properties

Compound Name2-(4-chloro-3-methylphenoxy)-N-(6-methyl-2-pyridinyl)acetamide
PubChem CID728258
Molecular FormulaC15H15ClN2O2
Molecular Weight290.75 g/mol
Exact Mass290.08
IUPAC Name2-(4-chloro-3-methylphenoxy)-N-(6-methyl-2-pyridinyl)acetamide
SMILESCc1cccc(NC(=O)COc2ccc(Cl)c(C)c2)n1
InChIInChI=1S/C15H15ClN2O2/c1-10-8-12(6-7-13(10)16)20-9-15(19)18-14-5-3-4-11(2)17-14/h3-8H,9H2,1-2H3,(H,17,18,19)
InChIKeyGQGMHLMNWTXHKP-UHFFFAOYSA-N
XLogP3.37
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.75
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chloro-3-methylphenoxy)-N-(6-methyl-2-pyridinyl)acetamide?
The IUPAC name of 2-(4-chloro-3-methylphenoxy)-N-(6-methyl-2-pyridinyl)acetamide (CID 728258) is 2-(4-chloro-3-methylphenoxy)-N-(6-methyl-2-pyridinyl)acetamide.
What is the SMILES notation for 2-(4-chloro-3-methylphenoxy)-N-(6-methyl-2-pyridinyl)acetamide?
The canonical SMILES for 2-(4-chloro-3-methylphenoxy)-N-(6-methyl-2-pyridinyl)acetamide is Cc1cccc(NC(=O)COc2ccc(Cl)c(C)c2)n1.
What is the InChIKey of 2-(4-chloro-3-methylphenoxy)-N-(6-methyl-2-pyridinyl)acetamide?
The InChIKey is GQGMHLMNWTXHKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O2/c1-10-8-12(6-7-13(10)16)20-9-15(19)18-14-5-3-4-11(2)17-14/h3-8H,9H2,1-2H3,(H,17,18,19).
What are the key properties of 2-(4-chloro-3-methylphenoxy)-N-(6-methyl-2-pyridinyl)acetamide?
2-(4-chloro-3-methylphenoxy)-N-(6-methyl-2-pyridinyl)acetamide has a molecular weight of 290.75 g/mol, XLogP of 3.37, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chloro-3-methylphenoxy)-N-(6-methyl-2-pyridinyl)acetamide is sourced from PubChem (CID 728258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).