2,6-dichloro-N-(5-chloro-2-fluorophenyl)pyridine-4-carboxamide

C12H6Cl3FN2O — CID 43384924

IUPAC2,6-dichloro-N-(5-chloro-2-fluorophenyl)pyridine-4-carboxamide
SMILESO=C(Nc1cc(Cl)ccc1F)c1cc(Cl)nc(Cl)c1
InChIInChI=1S/C12H6Cl3FN2O/c13-7-1-2-8(16)9(5-7)17-12(19)6-3-10(14)18-11(15)4-6/h1-5H,(H,17,19)
InChIKeyQRORPBULLXXFPN-UHFFFAOYSA-N
MW319.55 g/mol
LogP4.43
Rot. Bonds2

About 2,6-dichloro-N-(5-chloro-2-fluorophenyl)pyridine-4-carboxamide

2,6-dichloro-N-(5-chloro-2-fluorophenyl)pyridine-4-carboxamide (PubChem CID 43384924) has the molecular formula C12H6Cl3FN2O and a molecular weight of 319.55 g/mol. Its IUPAC name is 2,6-dichloro-N-(5-chloro-2-fluorophenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2,6-dichloro-N-(5-chloro-2-fluorophenyl)pyridine-4-carboxamide
PubChem CID43384924
Molecular FormulaC12H6Cl3FN2O
Molecular Weight319.55 g/mol
Exact Mass317.95
IUPAC Name2,6-dichloro-N-(5-chloro-2-fluorophenyl)pyridine-4-carboxamide
SMILESO=C(Nc1cc(Cl)ccc1F)c1cc(Cl)nc(Cl)c1
InChIInChI=1S/C12H6Cl3FN2O/c13-7-1-2-8(16)9(5-7)17-12(19)6-3-10(14)18-11(15)4-6/h1-5H,(H,17,19)
InChIKeyQRORPBULLXXFPN-UHFFFAOYSA-N
XLogP4.43
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.55
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2,6-dichloro-N-(2,4-difluorophenyl)pyridine-4-carboxamide
CID 26722050
6-chloro-N-(5-chloro-2-fluorophenyl)pyridine-3-carboxamide
CID 43384926
N-(5-chloro-2-fluorophenyl)-4-fluorobenzamide
CID 2664585
2,6-dichloro-N-(3-fluoro-4-pyridinyl)pyridine-4-carboxamide
CID 113342448
1-N,3-N,5-N-tris(5-chloro-2-hydroxyphenyl)benzene-1,3,5-tricarboxamide
CID 57074099
2-amino-N-(2-bromo-5-chlorophenyl)-6-chloropyridine-4-carboxamide
CID 81275531
2-chloro-N-(2-fluorophenyl)-6-hydrazinylpyridine-4-carboxamide
CID 62247770
4-chloro-N-(5-chloro-2-fluorophenyl)pyridine-2-carboxamide
CID 43385379
3-N-(5-chloro-2-fluorophenyl)benzene-1,3-dicarboxamide
CID 172831894
4-bromo-3-chloro-N-(5-chloro-2-fluorophenyl)benzamide
CID 81308166
4-chloro-N-(2,5-difluorophenyl)benzamide
CID 2969912
6-amino-N-(5-chloro-2-fluorophenyl)pyridine-2-carboxamide
CID 62239804

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N-(5-chloro-2-fluorophenyl)pyridine-4-carboxamide?
The IUPAC name of 2,6-dichloro-N-(5-chloro-2-fluorophenyl)pyridine-4-carboxamide (CID 43384924) is 2,6-dichloro-N-(5-chloro-2-fluorophenyl)pyridine-4-carboxamide.
What is the SMILES notation for 2,6-dichloro-N-(5-chloro-2-fluorophenyl)pyridine-4-carboxamide?
The canonical SMILES for 2,6-dichloro-N-(5-chloro-2-fluorophenyl)pyridine-4-carboxamide is O=C(Nc1cc(Cl)ccc1F)c1cc(Cl)nc(Cl)c1.
What is the InChIKey of 2,6-dichloro-N-(5-chloro-2-fluorophenyl)pyridine-4-carboxamide?
The InChIKey is QRORPBULLXXFPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H6Cl3FN2O/c13-7-1-2-8(16)9(5-7)17-12(19)6-3-10(14)18-11(15)4-6/h1-5H,(H,17,19).
What are the key properties of 2,6-dichloro-N-(5-chloro-2-fluorophenyl)pyridine-4-carboxamide?
2,6-dichloro-N-(5-chloro-2-fluorophenyl)pyridine-4-carboxamide has a molecular weight of 319.55 g/mol, XLogP of 4.43, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-N-(5-chloro-2-fluorophenyl)pyridine-4-carboxamide is sourced from PubChem (CID 43384924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).