5-amino-6-(2-carbamoylphenoxy)pyridine-2-carboxamide

C13H12N4O3 — CID 114408553

IUPAC5-amino-6-(2-carbamoylphenoxy)pyridine-2-carboxamide
SMILESNC(=O)c1ccc(N)c(Oc2ccccc2C(N)=O)n1
InChIInChI=1S/C13H12N4O3/c14-8-5-6-9(12(16)19)17-13(8)20-10-4-2-1-3-7(10)11(15)18/h1-6H,14H2,(H2,15,18)(H2,16,19)
InChIKeyKCFDMLMTKZLECS-UHFFFAOYSA-N
MW272.26 g/mol
LogP0.65
Rot. Bonds4

About 5-amino-6-(2-carbamoylphenoxy)pyridine-2-carboxamide

5-amino-6-(2-carbamoylphenoxy)pyridine-2-carboxamide (PubChem CID 114408553) has the molecular formula C13H12N4O3 and a molecular weight of 272.26 g/mol. Its IUPAC name is 5-amino-6-(2-carbamoylphenoxy)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-amino-6-(2-carbamoylphenoxy)pyridine-2-carboxamide
PubChem CID114408553
Molecular FormulaC13H12N4O3
Molecular Weight272.26 g/mol
Exact Mass272.09
IUPAC Name5-amino-6-(2-carbamoylphenoxy)pyridine-2-carboxamide
SMILESNC(=O)c1ccc(N)c(Oc2ccccc2C(N)=O)n1
InChIInChI=1S/C13H12N4O3/c14-8-5-6-9(12(16)19)17-13(8)20-10-4-2-1-3-7(10)11(15)18/h1-6H,14H2,(H2,15,18)(H2,16,19)
InChIKeyKCFDMLMTKZLECS-UHFFFAOYSA-N
XLogP0.65
TPSA134.32 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.26
LogP ≤ 50.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-amino-6-(2-carbamoylphenoxy)pyridine-2-carboxamide?
The IUPAC name of 5-amino-6-(2-carbamoylphenoxy)pyridine-2-carboxamide (CID 114408553) is 5-amino-6-(2-carbamoylphenoxy)pyridine-2-carboxamide.
What is the SMILES notation for 5-amino-6-(2-carbamoylphenoxy)pyridine-2-carboxamide?
The canonical SMILES for 5-amino-6-(2-carbamoylphenoxy)pyridine-2-carboxamide is NC(=O)c1ccc(N)c(Oc2ccccc2C(N)=O)n1.
What is the InChIKey of 5-amino-6-(2-carbamoylphenoxy)pyridine-2-carboxamide?
The InChIKey is KCFDMLMTKZLECS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N4O3/c14-8-5-6-9(12(16)19)17-13(8)20-10-4-2-1-3-7(10)11(15)18/h1-6H,14H2,(H2,15,18)(H2,16,19).
What are the key properties of 5-amino-6-(2-carbamoylphenoxy)pyridine-2-carboxamide?
5-amino-6-(2-carbamoylphenoxy)pyridine-2-carboxamide has a molecular weight of 272.26 g/mol, XLogP of 0.65, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-6-(2-carbamoylphenoxy)pyridine-2-carboxamide is sourced from PubChem (CID 114408553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).