2-[6-(2-chloro-4-fluorophenyl)-2-pyridinyl]-2-(2,6-dichlorophenyl)acetamide

C19H12Cl3FN2O — CID 21354159

IUPAC2-[6-(2-chloro-4-fluorophenyl)-2-pyridinyl]-2-(2,6-dichlorophenyl)acetamide
SMILESNC(=O)C(c1cccc(-c2ccc(F)cc2Cl)n1)c1c(Cl)cccc1Cl
InChIInChI=1S/C19H12Cl3FN2O/c20-12-3-1-4-13(21)17(12)18(19(24)26)16-6-2-5-15(25-16)11-8-7-10(23)9-14(11)22/h1-9,18H,(H2,24,26)
InChIKeyQOBXTXOLPGHRLF-UHFFFAOYSA-N
MW409.68 g/mol
LogP5.47
Rot. Bonds4

About 2-[6-(2-chloro-4-fluorophenyl)-2-pyridinyl]-2-(2,6-dichlorophenyl)acetamide

2-[6-(2-chloro-4-fluorophenyl)-2-pyridinyl]-2-(2,6-dichlorophenyl)acetamide (PubChem CID 21354159) has the molecular formula C19H12Cl3FN2O and a molecular weight of 409.68 g/mol. Its IUPAC name is 2-[6-(2-chloro-4-fluorophenyl)-2-pyridinyl]-2-(2,6-dichlorophenyl)acetamide.

Molecular Properties

Compound Name2-[6-(2-chloro-4-fluorophenyl)-2-pyridinyl]-2-(2,6-dichlorophenyl)acetamide
PubChem CID21354159
Molecular FormulaC19H12Cl3FN2O
Molecular Weight409.68 g/mol
Exact Mass408.00
IUPAC Name2-[6-(2-chloro-4-fluorophenyl)-2-pyridinyl]-2-(2,6-dichlorophenyl)acetamide
SMILESNC(=O)C(c1cccc(-c2ccc(F)cc2Cl)n1)c1c(Cl)cccc1Cl
InChIInChI=1S/C19H12Cl3FN2O/c20-12-3-1-4-13(21)17(12)18(19(24)26)16-6-2-5-15(25-16)11-8-7-10(23)9-14(11)22/h1-9,18H,(H2,24,26)
InChIKeyQOBXTXOLPGHRLF-UHFFFAOYSA-N
XLogP5.47
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500409.68
LogP ≤ 55.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[6-(2-chloro-4-fluorophenyl)-2-pyridinyl]-2-(2,6-dichlorophenyl)acetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[6-(2-chloro-4-fluorophenyl)-2-pyridinyl]-2-(2,6-dichlorophenyl)acetamide?
The IUPAC name of 2-[6-(2-chloro-4-fluorophenyl)-2-pyridinyl]-2-(2,6-dichlorophenyl)acetamide (CID 21354159) is 2-[6-(2-chloro-4-fluorophenyl)-2-pyridinyl]-2-(2,6-dichlorophenyl)acetamide.
What is the SMILES notation for 2-[6-(2-chloro-4-fluorophenyl)-2-pyridinyl]-2-(2,6-dichlorophenyl)acetamide?
The canonical SMILES for 2-[6-(2-chloro-4-fluorophenyl)-2-pyridinyl]-2-(2,6-dichlorophenyl)acetamide is NC(=O)C(c1cccc(-c2ccc(F)cc2Cl)n1)c1c(Cl)cccc1Cl.
What is the InChIKey of 2-[6-(2-chloro-4-fluorophenyl)-2-pyridinyl]-2-(2,6-dichlorophenyl)acetamide?
The InChIKey is QOBXTXOLPGHRLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12Cl3FN2O/c20-12-3-1-4-13(21)17(12)18(19(24)26)16-6-2-5-15(25-16)11-8-7-10(23)9-14(11)22/h1-9,18H,(H2,24,26).
What are the key properties of 2-[6-(2-chloro-4-fluorophenyl)-2-pyridinyl]-2-(2,6-dichlorophenyl)acetamide?
2-[6-(2-chloro-4-fluorophenyl)-2-pyridinyl]-2-(2,6-dichlorophenyl)acetamide has a molecular weight of 409.68 g/mol, XLogP of 5.47, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(2-chloro-4-fluorophenyl)-2-pyridinyl]-2-(2,6-dichlorophenyl)acetamide is sourced from PubChem (CID 21354159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).