5,6-dichloro-N-(6-fluoro-2-pyridinyl)pyridine-3-carboxamide

C11H6Cl2FN3O — CID 113462599

IUPAC5,6-dichloro-N-(6-fluoro-2-pyridinyl)pyridine-3-carboxamide
SMILESO=C(Nc1cccc(F)n1)c1cnc(Cl)c(Cl)c1
InChIInChI=1S/C11H6Cl2FN3O/c12-7-4-6(5-15-10(7)13)11(18)17-9-3-1-2-8(14)16-9/h1-5H,(H,16,17,18)
InChIKeyKLLQYFAWUGPYDV-UHFFFAOYSA-N
MW286.09 g/mol
LogP3.17
Rot. Bonds2

About 5,6-dichloro-N-(6-fluoro-2-pyridinyl)pyridine-3-carboxamide

5,6-dichloro-N-(6-fluoro-2-pyridinyl)pyridine-3-carboxamide (PubChem CID 113462599) has the molecular formula C11H6Cl2FN3O and a molecular weight of 286.09 g/mol. Its IUPAC name is 5,6-dichloro-N-(6-fluoro-2-pyridinyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5,6-dichloro-N-(6-fluoro-2-pyridinyl)pyridine-3-carboxamide
PubChem CID113462599
Molecular FormulaC11H6Cl2FN3O
Molecular Weight286.09 g/mol
Exact Mass284.99
IUPAC Name5,6-dichloro-N-(6-fluoro-2-pyridinyl)pyridine-3-carboxamide
SMILESO=C(Nc1cccc(F)n1)c1cnc(Cl)c(Cl)c1
InChIInChI=1S/C11H6Cl2FN3O/c12-7-4-6(5-15-10(7)13)11(18)17-9-3-1-2-8(14)16-9/h1-5H,(H,16,17,18)
InChIKeyKLLQYFAWUGPYDV-UHFFFAOYSA-N
XLogP3.17
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.09
LogP ≤ 53.17
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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Related Compounds

N-(5-bromo-6-methyl-2-pyridinyl)-5,6-dichloropyridine-3-carboxamide
CID 79048562
5,6-dichloro-N-(3,5-dichloro-4-fluorophenyl)pyridine-3-carboxamide
CID 107573379
3-fluoro-N-(6-fluoro-2-pyridinyl)-4-methylbenzamide
CID 104820807
N-(3-bromophenyl)-5,6-dichloropyridine-3-carboxamide
CID 2095074
4-chloro-N-(6-fluoro-2-pyridinyl)-5-iodothiophene-2-carboxamide
CID 71278112
5,6-dichloro-N'-(2-fluorobenzoyl)pyridine-3-carbohydrazide
CID 2087408
5,6-dichloro-N-(4-chloropyrimidin-2-yl)pyridine-3-carboxamide
CID 114052239
3-amino-5-fluoro-N-(6-fluoro-2-pyridinyl)-4-methylbenzamide
CID 116812510
5,6-dichloro-N-(2,4,5-trichlorophenyl)pyridine-3-carboxamide
CID 27687750
N-(4-carbamoylphenyl)-5,6-dichloropyridine-3-carboxamide
CID 7760364
3-(difluoromethoxy)-N-(6-fluoro-2-pyridinyl)benzamide
CID 104820521
N-(6-bromo-2-pyridinyl)-4-chloro-3-fluorobenzamide
CID 103875844

Frequently Asked Questions

What is the IUPAC name of 5,6-dichloro-N-(6-fluoro-2-pyridinyl)pyridine-3-carboxamide?
The IUPAC name of 5,6-dichloro-N-(6-fluoro-2-pyridinyl)pyridine-3-carboxamide (CID 113462599) is 5,6-dichloro-N-(6-fluoro-2-pyridinyl)pyridine-3-carboxamide.
What is the SMILES notation for 5,6-dichloro-N-(6-fluoro-2-pyridinyl)pyridine-3-carboxamide?
The canonical SMILES for 5,6-dichloro-N-(6-fluoro-2-pyridinyl)pyridine-3-carboxamide is O=C(Nc1cccc(F)n1)c1cnc(Cl)c(Cl)c1.
What is the InChIKey of 5,6-dichloro-N-(6-fluoro-2-pyridinyl)pyridine-3-carboxamide?
The InChIKey is KLLQYFAWUGPYDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6Cl2FN3O/c12-7-4-6(5-15-10(7)13)11(18)17-9-3-1-2-8(14)16-9/h1-5H,(H,16,17,18).
What are the key properties of 5,6-dichloro-N-(6-fluoro-2-pyridinyl)pyridine-3-carboxamide?
5,6-dichloro-N-(6-fluoro-2-pyridinyl)pyridine-3-carboxamide has a molecular weight of 286.09 g/mol, XLogP of 3.17, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dichloro-N-(6-fluoro-2-pyridinyl)pyridine-3-carboxamide is sourced from PubChem (CID 113462599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).