2-(2,4-dichlorophenoxy)-N-(3-pyridin-2-ylpropyl)acetamide

C16H16Cl2N2O2 — CID 110660985

IUPAC2-(2,4-dichlorophenoxy)-N-(3-pyridin-2-ylpropyl)acetamide
SMILESO=C(COc1ccc(Cl)cc1Cl)NCCCc1ccccn1
InChIInChI=1S/C16H16Cl2N2O2/c17-12-6-7-15(14(18)10-12)22-11-16(21)20-9-3-5-13-4-1-2-8-19-13/h1-2,4,6-8,10H,3,5,9,11H2,(H,20,21)
InChIKeyWBOMYAVZULAZKR-UHFFFAOYSA-N
MW339.22 g/mol
LogP3.52
Rot. Bonds7

About 2-(2,4-dichlorophenoxy)-N-(3-pyridin-2-ylpropyl)acetamide

2-(2,4-dichlorophenoxy)-N-(3-pyridin-2-ylpropyl)acetamide (PubChem CID 110660985) has the molecular formula C16H16Cl2N2O2 and a molecular weight of 339.22 g/mol. Its IUPAC name is 2-(2,4-dichlorophenoxy)-N-(3-pyridin-2-ylpropyl)acetamide.

Molecular Properties

Compound Name2-(2,4-dichlorophenoxy)-N-(3-pyridin-2-ylpropyl)acetamide
PubChem CID110660985
Molecular FormulaC16H16Cl2N2O2
Molecular Weight339.22 g/mol
Exact Mass338.06
IUPAC Name2-(2,4-dichlorophenoxy)-N-(3-pyridin-2-ylpropyl)acetamide
SMILESO=C(COc1ccc(Cl)cc1Cl)NCCCc1ccccn1
InChIInChI=1S/C16H16Cl2N2O2/c17-12-6-7-15(14(18)10-12)22-11-16(21)20-9-3-5-13-4-1-2-8-19-13/h1-2,4,6-8,10H,3,5,9,11H2,(H,20,21)
InChIKeyWBOMYAVZULAZKR-UHFFFAOYSA-N
XLogP3.52
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.22
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-(2,4-dichlorophenoxy)-N-(3-pyridin-2-ylpropyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2,4-dichlorophenoxy)-N-pyridin-2-ylacetamide
CID 792334
N-(3-aminooxypropyl)-2-(2,4-dichlorophenoxy)acetamide
CID 39401573
2-(2,4-dichlorophenoxy)-N-octylacetamide
CID 4555196
2-(2,4-dichlorophenoxy)-N-[3-(4-fluorophenyl)propyl]acetamide
CID 99993663
N-[4-(3-aminopropylamino)butyl]-2-(2,4-dichlorophenoxy)acetamide
CID 14751497
1-[3-(2,4-dichlorophenoxy)propyl]-2-methyl-3-(2-pyridin-2-ylethyl)guanidine
CID 111192266
N-(2-acetamidoethyl)-2-(2,4-dichlorophenoxy)acetamide
CID 7942051
2-(2,4-dichlorophenoxy)-N-(6-oxohexyl)acetamide
CID 89195114
2-(2,4-dichlorophenoxy)-N-(3-ethenylsulfonylpropyl)acetamide
CID 147530715
N-[3-[[2-(2,4-dichlorophenoxy)acetyl]amino]propyl]pyrazine-2-carboxamide
CID 6498608
2-(2,4-difluorophenoxy)-N-(2-pyridin-2-ylethyl)acetamide
CID 31971931
2-(2,4-dichlorophenoxy)-N-[3-(2-methoxyethoxy)propyl]acetamide
CID 134029604

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenoxy)-N-(3-pyridin-2-ylpropyl)acetamide?
The IUPAC name of 2-(2,4-dichlorophenoxy)-N-(3-pyridin-2-ylpropyl)acetamide (CID 110660985) is 2-(2,4-dichlorophenoxy)-N-(3-pyridin-2-ylpropyl)acetamide.
What is the SMILES notation for 2-(2,4-dichlorophenoxy)-N-(3-pyridin-2-ylpropyl)acetamide?
The canonical SMILES for 2-(2,4-dichlorophenoxy)-N-(3-pyridin-2-ylpropyl)acetamide is O=C(COc1ccc(Cl)cc1Cl)NCCCc1ccccn1.
What is the InChIKey of 2-(2,4-dichlorophenoxy)-N-(3-pyridin-2-ylpropyl)acetamide?
The InChIKey is WBOMYAVZULAZKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16Cl2N2O2/c17-12-6-7-15(14(18)10-12)22-11-16(21)20-9-3-5-13-4-1-2-8-19-13/h1-2,4,6-8,10H,3,5,9,11H2,(H,20,21).
What are the key properties of 2-(2,4-dichlorophenoxy)-N-(3-pyridin-2-ylpropyl)acetamide?
2-(2,4-dichlorophenoxy)-N-(3-pyridin-2-ylpropyl)acetamide has a molecular weight of 339.22 g/mol, XLogP of 3.52, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenoxy)-N-(3-pyridin-2-ylpropyl)acetamide is sourced from PubChem (CID 110660985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).