2-(4-chloro-3,5-dimethylphenoxy)-N-(5-chloro-2-pyridinyl)acetamide

C15H14Cl2N2O2 — CID 738265

IUPAC2-(4-chloro-3,5-dimethylphenoxy)-N-(5-chloro-2-pyridinyl)acetamide
SMILESCc1cc(OCC(=O)Nc2ccc(Cl)cn2)cc(C)c1Cl
InChIInChI=1S/C15H14Cl2N2O2/c1-9-5-12(6-10(2)15(9)17)21-8-14(20)19-13-4-3-11(16)7-18-13/h3-7H,8H2,1-2H3,(H,18,19,20)
InChIKeyBLBIVCQKZWOMQQ-UHFFFAOYSA-N
MW325.20 g/mol
LogP4.02
Rot. Bonds4

About 2-(4-chloro-3,5-dimethylphenoxy)-N-(5-chloro-2-pyridinyl)acetamide

2-(4-chloro-3,5-dimethylphenoxy)-N-(5-chloro-2-pyridinyl)acetamide (PubChem CID 738265) has the molecular formula C15H14Cl2N2O2 and a molecular weight of 325.20 g/mol. Its IUPAC name is 2-(4-chloro-3,5-dimethylphenoxy)-N-(5-chloro-2-pyridinyl)acetamide.

Molecular Properties

Compound Name2-(4-chloro-3,5-dimethylphenoxy)-N-(5-chloro-2-pyridinyl)acetamide
PubChem CID738265
Molecular FormulaC15H14Cl2N2O2
Molecular Weight325.20 g/mol
Exact Mass324.04
IUPAC Name2-(4-chloro-3,5-dimethylphenoxy)-N-(5-chloro-2-pyridinyl)acetamide
SMILESCc1cc(OCC(=O)Nc2ccc(Cl)cn2)cc(C)c1Cl
InChIInChI=1S/C15H14Cl2N2O2/c1-9-5-12(6-10(2)15(9)17)21-8-14(20)19-13-4-3-11(16)7-18-13/h3-7H,8H2,1-2H3,(H,18,19,20)
InChIKeyBLBIVCQKZWOMQQ-UHFFFAOYSA-N
XLogP4.02
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.20
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chloro-3,5-dimethylphenoxy)-N-(5-chloro-2-pyridinyl)acetamide?
The IUPAC name of 2-(4-chloro-3,5-dimethylphenoxy)-N-(5-chloro-2-pyridinyl)acetamide (CID 738265) is 2-(4-chloro-3,5-dimethylphenoxy)-N-(5-chloro-2-pyridinyl)acetamide.
What is the SMILES notation for 2-(4-chloro-3,5-dimethylphenoxy)-N-(5-chloro-2-pyridinyl)acetamide?
The canonical SMILES for 2-(4-chloro-3,5-dimethylphenoxy)-N-(5-chloro-2-pyridinyl)acetamide is Cc1cc(OCC(=O)Nc2ccc(Cl)cn2)cc(C)c1Cl.
What is the InChIKey of 2-(4-chloro-3,5-dimethylphenoxy)-N-(5-chloro-2-pyridinyl)acetamide?
The InChIKey is BLBIVCQKZWOMQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14Cl2N2O2/c1-9-5-12(6-10(2)15(9)17)21-8-14(20)19-13-4-3-11(16)7-18-13/h3-7H,8H2,1-2H3,(H,18,19,20).
What are the key properties of 2-(4-chloro-3,5-dimethylphenoxy)-N-(5-chloro-2-pyridinyl)acetamide?
2-(4-chloro-3,5-dimethylphenoxy)-N-(5-chloro-2-pyridinyl)acetamide has a molecular weight of 325.20 g/mol, XLogP of 4.02, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chloro-3,5-dimethylphenoxy)-N-(5-chloro-2-pyridinyl)acetamide is sourced from PubChem (CID 738265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).