2-(2,4-dichloro-5-methylphenoxy)-N-pyridin-4-ylacetamide

C14H12Cl2N2O2 — CID 134123433

IUPAC2-(2,4-dichloro-5-methylphenoxy)-N-pyridin-4-ylacetamide
SMILESCc1cc(OCC(=O)Nc2ccncc2)c(Cl)cc1Cl
InChIInChI=1S/C14H12Cl2N2O2/c1-9-6-13(12(16)7-11(9)15)20-8-14(19)18-10-2-4-17-5-3-10/h2-7H,8H2,1H3,(H,17,18,19)
InChIKeySNZUZCXUDLRPFN-UHFFFAOYSA-N
MW311.17 g/mol
LogP3.71
Rot. Bonds4

About 2-(2,4-dichloro-5-methylphenoxy)-N-pyridin-4-ylacetamide

2-(2,4-dichloro-5-methylphenoxy)-N-pyridin-4-ylacetamide (PubChem CID 134123433) has the molecular formula C14H12Cl2N2O2 and a molecular weight of 311.17 g/mol. Its IUPAC name is 2-(2,4-dichloro-5-methylphenoxy)-N-pyridin-4-ylacetamide.

Molecular Properties

Compound Name2-(2,4-dichloro-5-methylphenoxy)-N-pyridin-4-ylacetamide
PubChem CID134123433
Molecular FormulaC14H12Cl2N2O2
Molecular Weight311.17 g/mol
Exact Mass310.03
IUPAC Name2-(2,4-dichloro-5-methylphenoxy)-N-pyridin-4-ylacetamide
SMILESCc1cc(OCC(=O)Nc2ccncc2)c(Cl)cc1Cl
InChIInChI=1S/C14H12Cl2N2O2/c1-9-6-13(12(16)7-11(9)15)20-8-14(19)18-10-2-4-17-5-3-10/h2-7H,8H2,1H3,(H,17,18,19)
InChIKeySNZUZCXUDLRPFN-UHFFFAOYSA-N
XLogP3.71
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.17
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-methylphenoxy)-N-pyridin-4-ylacetamide
CID 1101312
2-(2-chlorophenoxy)-N-pyridin-4-ylacetamide
CID 21229438
2-(2-chloro-5-methylphenoxy)-N-(3,4-dimethylphenyl)acetamide
CID 7642767
N-(4-acetylphenyl)-2-(2,4,5-trichlorophenoxy)acetamide
CID 1047129
N-(4-acetamidophenyl)-2-(2-chloro-5-methylphenoxy)acetamide
CID 7731856
2-(2-ethoxyphenoxy)-N-pyridin-4-ylacetamide
CID 78802593
N-(4-aminophenyl)-2-(2,4,5-trichlorophenoxy)acetamide
CID 29274448
N-(4-bromo-3-methylphenyl)-2-(4-chloro-5-methyl-2-propan-2-ylphenoxy)acetamide
CID 7959173
2-(4-chlorophenoxy)-N-pyridin-4-ylacetamide;hydrochloride
CID 163329233
2-[2-chloro-4-[(3-chloro-4-methylanilino)methyl]phenoxy]-N-(3-chloro-4-methylphenyl)acetamide
CID 126267103
N-(4-acetamidophenyl)-2-(2,4-dichlorophenoxy)acetamide
CID 1039828
2-(4-chloro-2,6-dimethylphenoxy)-N-(3-chloro-4-methylphenyl)acetamide
CID 7900401

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichloro-5-methylphenoxy)-N-pyridin-4-ylacetamide?
The IUPAC name of 2-(2,4-dichloro-5-methylphenoxy)-N-pyridin-4-ylacetamide (CID 134123433) is 2-(2,4-dichloro-5-methylphenoxy)-N-pyridin-4-ylacetamide.
What is the SMILES notation for 2-(2,4-dichloro-5-methylphenoxy)-N-pyridin-4-ylacetamide?
The canonical SMILES for 2-(2,4-dichloro-5-methylphenoxy)-N-pyridin-4-ylacetamide is Cc1cc(OCC(=O)Nc2ccncc2)c(Cl)cc1Cl.
What is the InChIKey of 2-(2,4-dichloro-5-methylphenoxy)-N-pyridin-4-ylacetamide?
The InChIKey is SNZUZCXUDLRPFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2N2O2/c1-9-6-13(12(16)7-11(9)15)20-8-14(19)18-10-2-4-17-5-3-10/h2-7H,8H2,1H3,(H,17,18,19).
What are the key properties of 2-(2,4-dichloro-5-methylphenoxy)-N-pyridin-4-ylacetamide?
2-(2,4-dichloro-5-methylphenoxy)-N-pyridin-4-ylacetamide has a molecular weight of 311.17 g/mol, XLogP of 3.71, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichloro-5-methylphenoxy)-N-pyridin-4-ylacetamide is sourced from PubChem (CID 134123433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).