5-chloro-2-(2,6-difluorophenoxy)pyridine-3-carboxamide

C12H7ClF2N2O2 — CID 141125071

IUPAC5-chloro-2-(2,6-difluorophenoxy)pyridine-3-carboxamide
SMILESNC(=O)c1cc(Cl)cnc1Oc1c(F)cccc1F
InChIInChI=1S/C12H7ClF2N2O2/c13-6-4-7(11(16)18)12(17-5-6)19-10-8(14)2-1-3-9(10)15/h1-5H,(H2,16,18)
InChIKeyBUGDAMCLWDLTHI-UHFFFAOYSA-N
MW284.65 g/mol
LogP2.90
Rot. Bonds3

About 5-chloro-2-(2,6-difluorophenoxy)pyridine-3-carboxamide

5-chloro-2-(2,6-difluorophenoxy)pyridine-3-carboxamide (PubChem CID 141125071) has the molecular formula C12H7ClF2N2O2 and a molecular weight of 284.65 g/mol. Its IUPAC name is 5-chloro-2-(2,6-difluorophenoxy)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-2-(2,6-difluorophenoxy)pyridine-3-carboxamide
PubChem CID141125071
Molecular FormulaC12H7ClF2N2O2
Molecular Weight284.65 g/mol
Exact Mass284.02
IUPAC Name5-chloro-2-(2,6-difluorophenoxy)pyridine-3-carboxamide
SMILESNC(=O)c1cc(Cl)cnc1Oc1c(F)cccc1F
InChIInChI=1S/C12H7ClF2N2O2/c13-6-4-7(11(16)18)12(17-5-6)19-10-8(14)2-1-3-9(10)15/h1-5H,(H2,16,18)
InChIKeyBUGDAMCLWDLTHI-UHFFFAOYSA-N
XLogP2.90
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.65
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-(2,6-difluorophenoxy)pyridine-3-carboxamide?
The IUPAC name of 5-chloro-2-(2,6-difluorophenoxy)pyridine-3-carboxamide (CID 141125071) is 5-chloro-2-(2,6-difluorophenoxy)pyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-2-(2,6-difluorophenoxy)pyridine-3-carboxamide?
The canonical SMILES for 5-chloro-2-(2,6-difluorophenoxy)pyridine-3-carboxamide is NC(=O)c1cc(Cl)cnc1Oc1c(F)cccc1F.
What is the InChIKey of 5-chloro-2-(2,6-difluorophenoxy)pyridine-3-carboxamide?
The InChIKey is BUGDAMCLWDLTHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7ClF2N2O2/c13-6-4-7(11(16)18)12(17-5-6)19-10-8(14)2-1-3-9(10)15/h1-5H,(H2,16,18).
What are the key properties of 5-chloro-2-(2,6-difluorophenoxy)pyridine-3-carboxamide?
5-chloro-2-(2,6-difluorophenoxy)pyridine-3-carboxamide has a molecular weight of 284.65 g/mol, XLogP of 2.90, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-(2,6-difluorophenoxy)pyridine-3-carboxamide is sourced from PubChem (CID 141125071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).