2-(2,4-dichloro-6-methyl-3-pyridinyl)-N-[2-(difluoromethoxy)phenyl]acetamide

C15H12Cl2F2N2O2 — CID 24509105

IUPAC2-(2,4-dichloro-6-methyl-3-pyridinyl)-N-[2-(difluoromethoxy)phenyl]acetamide
SMILESCc1cc(Cl)c(CC(=O)Nc2ccccc2OC(F)F)c(Cl)n1
InChIInChI=1S/C15H12Cl2F2N2O2/c1-8-6-10(16)9(14(17)20-8)7-13(22)21-11-4-2-3-5-12(11)23-15(18)19/h2-6,15H,7H2,1H3,(H,21,22)
InChIKeyIOOWQZURYBDOIV-UHFFFAOYSA-N
MW361.18 g/mol
LogP4.48
Rot. Bonds5

About 2-(2,4-dichloro-6-methyl-3-pyridinyl)-N-[2-(difluoromethoxy)phenyl]acetamide

2-(2,4-dichloro-6-methyl-3-pyridinyl)-N-[2-(difluoromethoxy)phenyl]acetamide (PubChem CID 24509105) has the molecular formula C15H12Cl2F2N2O2 and a molecular weight of 361.18 g/mol. Its IUPAC name is 2-(2,4-dichloro-6-methyl-3-pyridinyl)-N-[2-(difluoromethoxy)phenyl]acetamide.

Molecular Properties

Compound Name2-(2,4-dichloro-6-methyl-3-pyridinyl)-N-[2-(difluoromethoxy)phenyl]acetamide
PubChem CID24509105
Molecular FormulaC15H12Cl2F2N2O2
Molecular Weight361.18 g/mol
Exact Mass360.02
IUPAC Name2-(2,4-dichloro-6-methyl-3-pyridinyl)-N-[2-(difluoromethoxy)phenyl]acetamide
SMILESCc1cc(Cl)c(CC(=O)Nc2ccccc2OC(F)F)c(Cl)n1
InChIInChI=1S/C15H12Cl2F2N2O2/c1-8-6-10(16)9(14(17)20-8)7-13(22)21-11-4-2-3-5-12(11)23-15(18)19/h2-6,15H,7H2,1H3,(H,21,22)
InChIKeyIOOWQZURYBDOIV-UHFFFAOYSA-N
XLogP4.48
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.18
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichloro-6-methyl-3-pyridinyl)-N-[2-(difluoromethoxy)phenyl]acetamide?
The IUPAC name of 2-(2,4-dichloro-6-methyl-3-pyridinyl)-N-[2-(difluoromethoxy)phenyl]acetamide (CID 24509105) is 2-(2,4-dichloro-6-methyl-3-pyridinyl)-N-[2-(difluoromethoxy)phenyl]acetamide.
What is the SMILES notation for 2-(2,4-dichloro-6-methyl-3-pyridinyl)-N-[2-(difluoromethoxy)phenyl]acetamide?
The canonical SMILES for 2-(2,4-dichloro-6-methyl-3-pyridinyl)-N-[2-(difluoromethoxy)phenyl]acetamide is Cc1cc(Cl)c(CC(=O)Nc2ccccc2OC(F)F)c(Cl)n1.
What is the InChIKey of 2-(2,4-dichloro-6-methyl-3-pyridinyl)-N-[2-(difluoromethoxy)phenyl]acetamide?
The InChIKey is IOOWQZURYBDOIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12Cl2F2N2O2/c1-8-6-10(16)9(14(17)20-8)7-13(22)21-11-4-2-3-5-12(11)23-15(18)19/h2-6,15H,7H2,1H3,(H,21,22).
What are the key properties of 2-(2,4-dichloro-6-methyl-3-pyridinyl)-N-[2-(difluoromethoxy)phenyl]acetamide?
2-(2,4-dichloro-6-methyl-3-pyridinyl)-N-[2-(difluoromethoxy)phenyl]acetamide has a molecular weight of 361.18 g/mol, XLogP of 4.48, 5 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-methyl-3-pyridinyl)-N-[2-(difluoromethoxy)phenyl]acetamide is sourced from PubChem (CID 24509105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).