2,6-dichloro-5-fluoropyridine-3-carboxamide

C6H3Cl2FN2O — CID 2774022

IUPAC2,6-dichloro-5-fluoropyridine-3-carboxamide
SMILESNC(=O)c1cc(F)c(Cl)nc1Cl
InChIInChI=1S/C6H3Cl2FN2O/c7-4-2(6(10)12)1-3(9)5(8)11-4/h1H,(H2,10,12)
InChIKeyZVYNUGSPFZCYEV-UHFFFAOYSA-N
MW209.01 g/mol
LogP1.63
Rot. Bonds1

About 2,6-dichloro-5-fluoropyridine-3-carboxamide

2,6-dichloro-5-fluoropyridine-3-carboxamide (PubChem CID 2774022) has the molecular formula C6H3Cl2FN2O and a molecular weight of 209.01 g/mol. Its IUPAC name is 2,6-dichloro-5-fluoropyridine-3-carboxamide.

Molecular Properties

Compound Name2,6-dichloro-5-fluoropyridine-3-carboxamide
PubChem CID2774022
Molecular FormulaC6H3Cl2FN2O
Molecular Weight209.01 g/mol
Exact Mass207.96
IUPAC Name2,6-dichloro-5-fluoropyridine-3-carboxamide
SMILESNC(=O)c1cc(F)c(Cl)nc1Cl
InChIInChI=1S/C6H3Cl2FN2O/c7-4-2(6(10)12)1-3(9)5(8)11-4/h1H,(H2,10,12)
InChIKeyZVYNUGSPFZCYEV-UHFFFAOYSA-N
XLogP1.63
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.01
LogP ≤ 51.63
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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Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-5-fluoropyridine-3-carboxamide?
The IUPAC name of 2,6-dichloro-5-fluoropyridine-3-carboxamide (CID 2774022) is 2,6-dichloro-5-fluoropyridine-3-carboxamide.
What is the SMILES notation for 2,6-dichloro-5-fluoropyridine-3-carboxamide?
The canonical SMILES for 2,6-dichloro-5-fluoropyridine-3-carboxamide is NC(=O)c1cc(F)c(Cl)nc1Cl.
What is the InChIKey of 2,6-dichloro-5-fluoropyridine-3-carboxamide?
The InChIKey is ZVYNUGSPFZCYEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3Cl2FN2O/c7-4-2(6(10)12)1-3(9)5(8)11-4/h1H,(H2,10,12).
What are the key properties of 2,6-dichloro-5-fluoropyridine-3-carboxamide?
2,6-dichloro-5-fluoropyridine-3-carboxamide has a molecular weight of 209.01 g/mol, XLogP of 1.63, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-5-fluoropyridine-3-carboxamide is sourced from PubChem (CID 2774022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).