2-(2,4-dichloro-6-methylphenoxy)-N-pyridin-3-ylacetamide

C14H12Cl2N2O2 — CID 738217

IUPAC2-(2,4-dichloro-6-methylphenoxy)-N-pyridin-3-ylacetamide
SMILESCc1cc(Cl)cc(Cl)c1OCC(=O)Nc1cccnc1
InChIInChI=1S/C14H12Cl2N2O2/c1-9-5-10(15)6-12(16)14(9)20-8-13(19)18-11-3-2-4-17-7-11/h2-7H,8H2,1H3,(H,18,19)
InChIKeyVBCZYDDCAJNGFG-UHFFFAOYSA-N
MW311.17 g/mol
LogP3.71
Rot. Bonds4

About 2-(2,4-dichloro-6-methylphenoxy)-N-pyridin-3-ylacetamide

2-(2,4-dichloro-6-methylphenoxy)-N-pyridin-3-ylacetamide (PubChem CID 738217) has the molecular formula C14H12Cl2N2O2 and a molecular weight of 311.17 g/mol. Its IUPAC name is 2-(2,4-dichloro-6-methylphenoxy)-N-pyridin-3-ylacetamide.

Molecular Properties

Compound Name2-(2,4-dichloro-6-methylphenoxy)-N-pyridin-3-ylacetamide
PubChem CID738217
Molecular FormulaC14H12Cl2N2O2
Molecular Weight311.17 g/mol
Exact Mass310.03
IUPAC Name2-(2,4-dichloro-6-methylphenoxy)-N-pyridin-3-ylacetamide
SMILESCc1cc(Cl)cc(Cl)c1OCC(=O)Nc1cccnc1
InChIInChI=1S/C14H12Cl2N2O2/c1-9-5-10(15)6-12(16)14(9)20-8-13(19)18-11-3-2-4-17-7-11/h2-7H,8H2,1H3,(H,18,19)
InChIKeyVBCZYDDCAJNGFG-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-(3,5-dichlorophenoxy)-N-pyridin-3-ylacetamide
CID 75422770
2-(2,4-dichloro-6-methylphenoxy)-N-pyridin-2-ylacetamide
CID 2892737
2-(2,4-dichloro-6-methylphenoxy)-N-(3,5-dimethylphenyl)acetamide
CID 1121099
2-(2,4-dichloro-6-methylphenoxy)-N-(9,10-dioxoanthracen-2-yl)acetamide
CID 2892762
2-(2,4-dichloro-6-methylphenoxy)-N-(3,4-dimethoxyphenyl)acetamide
CID 1348476
2-(4-chloro-2,6-dimethylphenoxy)-N-(3-chloro-4-methylphenyl)acetamide
CID 7900401
N-(3-chloro-4-pyrrolidin-1-ylphenyl)-2-(2,4-dichloro-6-methylphenoxy)acetamide
CID 4043146
2-(4-bromo-2-chloro-6-methylphenoxy)-N-(3-methoxyphenyl)acetamide
CID 7290642
N-(2-amino-4-chlorophenyl)-2-(2,4-dichloro-6-methylphenoxy)acetamide
CID 91689111
2-(4-bromo-2-chloro-6-methylphenoxy)-N-(pyridin-3-ylmethyl)acetamide
CID 17401622
N-(3-methylphenyl)-2-pyridin-3-yloxyacetamide
CID 110856684
2-(2-bromo-4,6-dichlorophenoxy)-N-(3,4-dimethylphenyl)acetamide
CID 17095271

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichloro-6-methylphenoxy)-N-pyridin-3-ylacetamide?
The IUPAC name of 2-(2,4-dichloro-6-methylphenoxy)-N-pyridin-3-ylacetamide (CID 738217) is 2-(2,4-dichloro-6-methylphenoxy)-N-pyridin-3-ylacetamide.
What is the SMILES notation for 2-(2,4-dichloro-6-methylphenoxy)-N-pyridin-3-ylacetamide?
The canonical SMILES for 2-(2,4-dichloro-6-methylphenoxy)-N-pyridin-3-ylacetamide is Cc1cc(Cl)cc(Cl)c1OCC(=O)Nc1cccnc1.
What is the InChIKey of 2-(2,4-dichloro-6-methylphenoxy)-N-pyridin-3-ylacetamide?
The InChIKey is VBCZYDDCAJNGFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2N2O2/c1-9-5-10(15)6-12(16)14(9)20-8-13(19)18-11-3-2-4-17-7-11/h2-7H,8H2,1H3,(H,18,19).
What are the key properties of 2-(2,4-dichloro-6-methylphenoxy)-N-pyridin-3-ylacetamide?
2-(2,4-dichloro-6-methylphenoxy)-N-pyridin-3-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-6-methylphenoxy)-N-pyridin-3-ylacetamide is sourced from PubChem (CID 738217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).