5-amino-6-(2-methylcyclohexyl)oxypyridine-2-carboxamide

C13H19N3O2 — CID 114408551

IUPAC5-amino-6-(2-methylcyclohexyl)oxypyridine-2-carboxamide
SMILESCC1CCCCC1Oc1nc(C(N)=O)ccc1N
InChIInChI=1S/C13H19N3O2/c1-8-4-2-3-5-11(8)18-13-9(14)6-7-10(16-13)12(15)17/h6-8,11H,2-5,14H2,1H3,(H2,15,17)
InChIKeyIPNRYKOBPXGYLR-UHFFFAOYSA-N
MW249.31 g/mol
LogP1.72
Rot. Bonds3

About 5-amino-6-(2-methylcyclohexyl)oxypyridine-2-carboxamide

5-amino-6-(2-methylcyclohexyl)oxypyridine-2-carboxamide (PubChem CID 114408551) has the molecular formula C13H19N3O2 and a molecular weight of 249.31 g/mol. Its IUPAC name is 5-amino-6-(2-methylcyclohexyl)oxypyridine-2-carboxamide.

Molecular Properties

Compound Name5-amino-6-(2-methylcyclohexyl)oxypyridine-2-carboxamide
PubChem CID114408551
Molecular FormulaC13H19N3O2
Molecular Weight249.31 g/mol
Exact Mass249.15
IUPAC Name5-amino-6-(2-methylcyclohexyl)oxypyridine-2-carboxamide
SMILESCC1CCCCC1Oc1nc(C(N)=O)ccc1N
InChIInChI=1S/C13H19N3O2/c1-8-4-2-3-5-11(8)18-13-9(14)6-7-10(16-13)12(15)17/h6-8,11H,2-5,14H2,1H3,(H2,15,17)
InChIKeyIPNRYKOBPXGYLR-UHFFFAOYSA-N
XLogP1.72
TPSA91.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-amino-6-(2-methylcyclohexyl)oxypyridine-2-carboxamide?
The IUPAC name of 5-amino-6-(2-methylcyclohexyl)oxypyridine-2-carboxamide (CID 114408551) is 5-amino-6-(2-methylcyclohexyl)oxypyridine-2-carboxamide.
What is the SMILES notation for 5-amino-6-(2-methylcyclohexyl)oxypyridine-2-carboxamide?
The canonical SMILES for 5-amino-6-(2-methylcyclohexyl)oxypyridine-2-carboxamide is CC1CCCCC1Oc1nc(C(N)=O)ccc1N.
What is the InChIKey of 5-amino-6-(2-methylcyclohexyl)oxypyridine-2-carboxamide?
The InChIKey is IPNRYKOBPXGYLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O2/c1-8-4-2-3-5-11(8)18-13-9(14)6-7-10(16-13)12(15)17/h6-8,11H,2-5,14H2,1H3,(H2,15,17).
What are the key properties of 5-amino-6-(2-methylcyclohexyl)oxypyridine-2-carboxamide?
5-amino-6-(2-methylcyclohexyl)oxypyridine-2-carboxamide has a molecular weight of 249.31 g/mol, XLogP of 1.72, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-6-(2-methylcyclohexyl)oxypyridine-2-carboxamide is sourced from PubChem (CID 114408551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).