5-amino-2-(4-methylcyclohexyl)oxypyridine-4-carboxamide

C13H19N3O2 — CID 114090645

IUPAC5-amino-2-(4-methylcyclohexyl)oxypyridine-4-carboxamide
SMILESCC1CCC(Oc2cc(C(N)=O)c(N)cn2)CC1
InChIInChI=1S/C13H19N3O2/c1-8-2-4-9(5-3-8)18-12-6-10(13(15)17)11(14)7-16-12/h6-9H,2-5,14H2,1H3,(H2,15,17)
InChIKeyXXVYRHPAORJSBU-UHFFFAOYSA-N
MW249.31 g/mol
LogP1.72
Rot. Bonds3

About 5-amino-2-(4-methylcyclohexyl)oxypyridine-4-carboxamide

5-amino-2-(4-methylcyclohexyl)oxypyridine-4-carboxamide (PubChem CID 114090645) has the molecular formula C13H19N3O2 and a molecular weight of 249.31 g/mol. Its IUPAC name is 5-amino-2-(4-methylcyclohexyl)oxypyridine-4-carboxamide.

Molecular Properties

Compound Name5-amino-2-(4-methylcyclohexyl)oxypyridine-4-carboxamide
PubChem CID114090645
Molecular FormulaC13H19N3O2
Molecular Weight249.31 g/mol
Exact Mass249.15
IUPAC Name5-amino-2-(4-methylcyclohexyl)oxypyridine-4-carboxamide
SMILESCC1CCC(Oc2cc(C(N)=O)c(N)cn2)CC1
InChIInChI=1S/C13H19N3O2/c1-8-2-4-9(5-3-8)18-12-6-10(13(15)17)11(14)7-16-12/h6-9H,2-5,14H2,1H3,(H2,15,17)
InChIKeyXXVYRHPAORJSBU-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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Related Compounds

5-amino-2-[(4-methylcyclohexyl)methylamino]pyridine-4-carboxamide
CID 114090347
6-cyclopropyloxy-4-methylpyridin-3-amine
CID 126971824
methyl 5-bromo-2-cyclopropyloxypyridine-4-carboxylate
CID 154595238
2-amino-5-[(4-methylcyclohexyl)amino]pyridine-4-carboxamide
CID 114194775
6-cyclobutyloxy-4-methylpyridin-3-amine
CID 79176085
5-amino-2-(4-methoxyphenoxy)pyridine-4-carboxamide
CID 114090626
5-amino-2-[(2-methoxycyclopentyl)amino]pyridine-4-carboxamide
CID 114090303
2-amino-5-[(4-methylcycloheptyl)amino]benzamide
CID 114101707
6-cycloheptyloxy-4-methylpyridin-3-amine
CID 79176454
5-amino-2-(1-phenylethoxy)pyridine-4-carboxamide
CID 114090660
5-amino-2-(4-methylsulfanylphenoxy)pyridine-4-carboxamide
CID 114090771
4-fluoro-6-(4-methylcyclohexyl)oxypyrimidine
CID 115416019

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-(4-methylcyclohexyl)oxypyridine-4-carboxamide?
The IUPAC name of 5-amino-2-(4-methylcyclohexyl)oxypyridine-4-carboxamide (CID 114090645) is 5-amino-2-(4-methylcyclohexyl)oxypyridine-4-carboxamide.
What is the SMILES notation for 5-amino-2-(4-methylcyclohexyl)oxypyridine-4-carboxamide?
The canonical SMILES for 5-amino-2-(4-methylcyclohexyl)oxypyridine-4-carboxamide is CC1CCC(Oc2cc(C(N)=O)c(N)cn2)CC1.
What is the InChIKey of 5-amino-2-(4-methylcyclohexyl)oxypyridine-4-carboxamide?
The InChIKey is XXVYRHPAORJSBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O2/c1-8-2-4-9(5-3-8)18-12-6-10(13(15)17)11(14)7-16-12/h6-9H,2-5,14H2,1H3,(H2,15,17).
What are the key properties of 5-amino-2-(4-methylcyclohexyl)oxypyridine-4-carboxamide?
5-amino-2-(4-methylcyclohexyl)oxypyridine-4-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-2-(4-methylcyclohexyl)oxypyridine-4-carboxamide is sourced from PubChem (CID 114090645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).