5-amino-2-(2,5-difluorophenoxy)pyridine-4-carboxamide

C12H9F2N3O2 — CID 114090768

IUPAC5-amino-2-(2,5-difluorophenoxy)pyridine-4-carboxamide
SMILESNC(=O)c1cc(Oc2cc(F)ccc2F)ncc1N
InChIInChI=1S/C12H9F2N3O2/c13-6-1-2-8(14)10(3-6)19-11-4-7(12(16)18)9(15)5-17-11/h1-5H,15H2,(H2,16,18)
InChIKeyCYAIAJYRQZORFT-UHFFFAOYSA-N
MW265.22 g/mol
LogP1.83
Rot. Bonds3

About 5-amino-2-(2,5-difluorophenoxy)pyridine-4-carboxamide

5-amino-2-(2,5-difluorophenoxy)pyridine-4-carboxamide (PubChem CID 114090768) has the molecular formula C12H9F2N3O2 and a molecular weight of 265.22 g/mol. Its IUPAC name is 5-amino-2-(2,5-difluorophenoxy)pyridine-4-carboxamide.

Molecular Properties

Compound Name5-amino-2-(2,5-difluorophenoxy)pyridine-4-carboxamide
PubChem CID114090768
Molecular FormulaC12H9F2N3O2
Molecular Weight265.22 g/mol
Exact Mass265.07
IUPAC Name5-amino-2-(2,5-difluorophenoxy)pyridine-4-carboxamide
SMILESNC(=O)c1cc(Oc2cc(F)ccc2F)ncc1N
InChIInChI=1S/C12H9F2N3O2/c13-6-1-2-8(14)10(3-6)19-11-4-7(12(16)18)9(15)5-17-11/h1-5H,15H2,(H2,16,18)
InChIKeyCYAIAJYRQZORFT-UHFFFAOYSA-N
XLogP1.83
TPSA91.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.22
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-amino-2-(2,5-difluorophenoxy)pyridine-4-carboxamide?
The IUPAC name of 5-amino-2-(2,5-difluorophenoxy)pyridine-4-carboxamide (CID 114090768) is 5-amino-2-(2,5-difluorophenoxy)pyridine-4-carboxamide.
What is the SMILES notation for 5-amino-2-(2,5-difluorophenoxy)pyridine-4-carboxamide?
The canonical SMILES for 5-amino-2-(2,5-difluorophenoxy)pyridine-4-carboxamide is NC(=O)c1cc(Oc2cc(F)ccc2F)ncc1N.
What is the InChIKey of 5-amino-2-(2,5-difluorophenoxy)pyridine-4-carboxamide?
The InChIKey is CYAIAJYRQZORFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9F2N3O2/c13-6-1-2-8(14)10(3-6)19-11-4-7(12(16)18)9(15)5-17-11/h1-5H,15H2,(H2,16,18).
What are the key properties of 5-amino-2-(2,5-difluorophenoxy)pyridine-4-carboxamide?
5-amino-2-(2,5-difluorophenoxy)pyridine-4-carboxamide has a molecular weight of 265.22 g/mol, XLogP of 1.83, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-(2,5-difluorophenoxy)pyridine-4-carboxamide is sourced from PubChem (CID 114090768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).