2-amino-5-(4-fluoro-2-methylphenoxy)pyridine-4-carboxamide

C13H12FN3O2 — CID 114195706

IUPAC2-amino-5-(4-fluoro-2-methylphenoxy)pyridine-4-carboxamide
SMILESCc1cc(F)ccc1Oc1cnc(N)cc1C(N)=O
InChIInChI=1S/C13H12FN3O2/c1-7-4-8(14)2-3-10(7)19-11-6-17-12(15)5-9(11)13(16)18/h2-6H,1H3,(H2,15,17)(H2,16,18)
InChIKeySUEZKBSKZBNBIS-UHFFFAOYSA-N
MW261.26 g/mol
LogP2.00
Rot. Bonds3

About 2-amino-5-(4-fluoro-2-methylphenoxy)pyridine-4-carboxamide

2-amino-5-(4-fluoro-2-methylphenoxy)pyridine-4-carboxamide (PubChem CID 114195706) has the molecular formula C13H12FN3O2 and a molecular weight of 261.26 g/mol. Its IUPAC name is 2-amino-5-(4-fluoro-2-methylphenoxy)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-5-(4-fluoro-2-methylphenoxy)pyridine-4-carboxamide
PubChem CID114195706
Molecular FormulaC13H12FN3O2
Molecular Weight261.26 g/mol
Exact Mass261.09
IUPAC Name2-amino-5-(4-fluoro-2-methylphenoxy)pyridine-4-carboxamide
SMILESCc1cc(F)ccc1Oc1cnc(N)cc1C(N)=O
InChIInChI=1S/C13H12FN3O2/c1-7-4-8(14)2-3-10(7)19-11-6-17-12(15)5-9(11)13(16)18/h2-6H,1H3,(H2,15,17)(H2,16,18)
InChIKeySUEZKBSKZBNBIS-UHFFFAOYSA-N
XLogP2.00
TPSA91.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.26
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-5-(4-fluoro-2-methylphenoxy)pyridine-4-carboxamide?
The IUPAC name of 2-amino-5-(4-fluoro-2-methylphenoxy)pyridine-4-carboxamide (CID 114195706) is 2-amino-5-(4-fluoro-2-methylphenoxy)pyridine-4-carboxamide.
What is the SMILES notation for 2-amino-5-(4-fluoro-2-methylphenoxy)pyridine-4-carboxamide?
The canonical SMILES for 2-amino-5-(4-fluoro-2-methylphenoxy)pyridine-4-carboxamide is Cc1cc(F)ccc1Oc1cnc(N)cc1C(N)=O.
What is the InChIKey of 2-amino-5-(4-fluoro-2-methylphenoxy)pyridine-4-carboxamide?
The InChIKey is SUEZKBSKZBNBIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12FN3O2/c1-7-4-8(14)2-3-10(7)19-11-6-17-12(15)5-9(11)13(16)18/h2-6H,1H3,(H2,15,17)(H2,16,18).
What are the key properties of 2-amino-5-(4-fluoro-2-methylphenoxy)pyridine-4-carboxamide?
2-amino-5-(4-fluoro-2-methylphenoxy)pyridine-4-carboxamide has a molecular weight of 261.26 g/mol, XLogP of 2.00, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-(4-fluoro-2-methylphenoxy)pyridine-4-carboxamide is sourced from PubChem (CID 114195706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).