methyl 6-amino-5-methoxypyridine-2-carboxylate;methyl 2-cyclopropyl-8-methoxy-[1,2,4]triazolo[1,5-a]pyridine-5-carboxylate

C20H23N5O6 — CID 162153799

IUPACmethyl 6-amino-5-methoxypyridine-2-carboxylate;methyl 2-cyclopropyl-8-methoxy-[1,2,4]triazolo[1,5-a]pyridine-5-carboxylate
SMILESCOC(=O)c1ccc(OC)c(N)n1.COC(=O)c1ccc(OC)c2nc(C3CC3)nn12
InChIInChI=1S/C12H13N3O3.C8H10N2O3/c1-17-9-6-5-8(12(16)18-2)15-11(9)13-10(14-15)7-3-4-7;1-12-6-4-3-5(8(11)13-2)10-7(6)9/h5-7H,3-4H2,1-2H3;3-4H,1-2H3,(H2,9,10)
InChIKeyZLOCNMDZSPHDFA-UHFFFAOYSA-N
MW429.43 g/mol
LogP1.86
Rot. Bonds5

About methyl 6-amino-5-methoxypyridine-2-carboxylate;methyl 2-cyclopropyl-8-methoxy-[1,2,4]triazolo[1,5-a]pyridine-5-carboxylate

methyl 6-amino-5-methoxypyridine-2-carboxylate;methyl 2-cyclopropyl-8-methoxy-[1,2,4]triazolo[1,5-a]pyridine-5-carboxylate (PubChem CID 162153799) has the molecular formula C20H23N5O6 and a molecular weight of 429.43 g/mol. Its IUPAC name is methyl 6-amino-5-methoxypyridine-2-carboxylate;methyl 2-cyclopropyl-8-methoxy-[1,2,4]triazolo[1,5-a]pyridine-5-carboxylate.

Molecular Properties

Compound Namemethyl 6-amino-5-methoxypyridine-2-carboxylate;methyl 2-cyclopropyl-8-methoxy-[1,2,4]triazolo[1,5-a]pyridine-5-carboxylate
PubChem CID162153799
Molecular FormulaC20H23N5O6
Molecular Weight429.43 g/mol
Exact Mass429.16
IUPAC Namemethyl 6-amino-5-methoxypyridine-2-carboxylate;methyl 2-cyclopropyl-8-methoxy-[1,2,4]triazolo[1,5-a]pyridine-5-carboxylate
SMILESCOC(=O)c1ccc(OC)c(N)n1.COC(=O)c1ccc(OC)c2nc(C3CC3)nn12
InChIInChI=1S/C12H13N3O3.C8H10N2O3/c1-17-9-6-5-8(12(16)18-2)15-11(9)13-10(14-15)7-3-4-7;1-12-6-4-3-5(8(11)13-2)10-7(6)9/h5-7H,3-4H2,1-2H3;3-4H,1-2H3,(H2,9,10)
InChIKeyZLOCNMDZSPHDFA-UHFFFAOYSA-N
XLogP1.86
TPSA140.16 Ų
H-Bond Donors1
H-Bond Acceptors11
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500429.43
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1011

Analyze methyl 6-amino-5-methoxypyridine-2-carboxylate;methyl 2-cyclopropyl-8-methoxy-[1,2,4]triazolo[1,5-a]pyridine-5-carboxylate with MolForge

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Related Compounds

2-(2-chlorophenyl)-1-(2-cyclopropyl-8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-5-yl)ethanone;methyl 2-cyclopropyl-8-methoxy-[1,2,4]triazolo[1,5-a]pyridine-5-carboxylate
CID 158737252
CID 88576732
CID 88576732
(2-cyclopropyl-8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-5-yl)boronic acid
CID 58074662
N-[[4-(2-cyclopropyl-8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-5-yl)phenyl]methyl]acetamide
CID 46834673
2-cyclopropyl-8-methoxy-5-phenyl-[1,2,4]triazolo[1,5-a]pyridine
CID 46833824
methyl 2-[1-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclopropyl]-8-methoxy-[1,2,4]triazolo[1,5-a]pyridine-5-carboxylate
CID 59313178
5-(2-cyclopropyl-8-methoxy-[1,2,4]triazolo[1,5-a]pyridin-5-yl)pyridine-3-carbonitrile;2-methylsulfonylethylcarbamic acid
CID 118913997
6-(6-cyclopropyl-7-methoxyimidazo[1,2-b]pyridazin-3-yl)-3-methoxypyridin-2-amine
CID 170631104
methyl 7-amino-2-cyclopropyl-6-(3-hydroxy-2,6-dimethylphenyl)-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylate
CID 177042882
methyl 5-amino-6-iodopyridine-2-carboxylate
CID 53485922
2-cyclobutyl-7-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-5-amine
CID 169150760
methyl 2-cyclobutyl-[1,2,4]triazolo[1,5-a]pyridine-8-carboxylate
CID 117137744

Frequently Asked Questions

What is the IUPAC name of methyl 6-amino-5-methoxypyridine-2-carboxylate;methyl 2-cyclopropyl-8-methoxy-[1,2,4]triazolo[1,5-a]pyridine-5-carboxylate?
The IUPAC name of methyl 6-amino-5-methoxypyridine-2-carboxylate;methyl 2-cyclopropyl-8-methoxy-[1,2,4]triazolo[1,5-a]pyridine-5-carboxylate (CID 162153799) is methyl 6-amino-5-methoxypyridine-2-carboxylate;methyl 2-cyclopropyl-8-methoxy-[1,2,4]triazolo[1,5-a]pyridine-5-carboxylate.
What is the SMILES notation for methyl 6-amino-5-methoxypyridine-2-carboxylate;methyl 2-cyclopropyl-8-methoxy-[1,2,4]triazolo[1,5-a]pyridine-5-carboxylate?
The canonical SMILES for methyl 6-amino-5-methoxypyridine-2-carboxylate;methyl 2-cyclopropyl-8-methoxy-[1,2,4]triazolo[1,5-a]pyridine-5-carboxylate is COC(=O)c1ccc(OC)c(N)n1.COC(=O)c1ccc(OC)c2nc(C3CC3)nn12.
What is the InChIKey of methyl 6-amino-5-methoxypyridine-2-carboxylate;methyl 2-cyclopropyl-8-methoxy-[1,2,4]triazolo[1,5-a]pyridine-5-carboxylate?
The InChIKey is ZLOCNMDZSPHDFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3O3.C8H10N2O3/c1-17-9-6-5-8(12(16)18-2)15-11(9)13-10(14-15)7-3-4-7;1-12-6-4-3-5(8(11)13-2)10-7(6)9/h5-7H,3-4H2,1-2H3;3-4H,1-2H3,(H2,9,10).
What are the key properties of methyl 6-amino-5-methoxypyridine-2-carboxylate;methyl 2-cyclopropyl-8-methoxy-[1,2,4]triazolo[1,5-a]pyridine-5-carboxylate?
methyl 6-amino-5-methoxypyridine-2-carboxylate;methyl 2-cyclopropyl-8-methoxy-[1,2,4]triazolo[1,5-a]pyridine-5-carboxylate has a molecular weight of 429.43 g/mol, XLogP of 1.86, 5 rotatable bonds, 1 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 6-amino-5-methoxypyridine-2-carboxylate;methyl 2-cyclopropyl-8-methoxy-[1,2,4]triazolo[1,5-a]pyridine-5-carboxylate is sourced from PubChem (CID 162153799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).