methyl 2-amino-5-[(2-methyl-3-pyridinyl)oxy]pyridine-4-carboxylate

C13H13N3O3 — CID 114195699

IUPACmethyl 2-amino-5-[(2-methyl-3-pyridinyl)oxy]pyridine-4-carboxylate
SMILESCOC(=O)c1cc(N)ncc1Oc1cccnc1C
InChIInChI=1S/C13H13N3O3/c1-8-10(4-3-5-15-8)19-11-7-16-12(14)6-9(11)13(17)18-2/h3-7H,1-2H3,(H2,14,16)
InChIKeyIWNXYEYBAPHWSP-UHFFFAOYSA-N
MW259.27 g/mol
LogP1.95
Rot. Bonds3

About methyl 2-amino-5-[(2-methyl-3-pyridinyl)oxy]pyridine-4-carboxylate

methyl 2-amino-5-[(2-methyl-3-pyridinyl)oxy]pyridine-4-carboxylate (PubChem CID 114195699) has the molecular formula C13H13N3O3 and a molecular weight of 259.27 g/mol. Its IUPAC name is methyl 2-amino-5-[(2-methyl-3-pyridinyl)oxy]pyridine-4-carboxylate.

Molecular Properties

Compound Namemethyl 2-amino-5-[(2-methyl-3-pyridinyl)oxy]pyridine-4-carboxylate
PubChem CID114195699
Molecular FormulaC13H13N3O3
Molecular Weight259.27 g/mol
Exact Mass259.10
IUPAC Namemethyl 2-amino-5-[(2-methyl-3-pyridinyl)oxy]pyridine-4-carboxylate
SMILESCOC(=O)c1cc(N)ncc1Oc1cccnc1C
InChIInChI=1S/C13H13N3O3/c1-8-10(4-3-5-15-8)19-11-7-16-12(14)6-9(11)13(17)18-2/h3-7H,1-2H3,(H2,14,16)
InChIKeyIWNXYEYBAPHWSP-UHFFFAOYSA-N
XLogP1.95
TPSA87.33 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.27
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze methyl 2-amino-5-[(2-methyl-3-pyridinyl)oxy]pyridine-4-carboxylate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

methyl 2-amino-5-(3-iodophenoxy)pyridine-4-carboxylate
CID 114195654
methyl 2-amino-5-pyrimidin-2-ylsulfanylpyridine-4-carboxylate
CID 114195751
methyl 2-methylpyridine-3-carboxylate
CID 7015327
methanol;methyl 2-methylpyridine-3-carboxylate
CID 174704345
4-amino-3-[(2-methyl-3-pyridinyl)oxy]benzoic acid
CID 82795845
5-amino-6-[(2-methyl-3-pyridinyl)oxy]pyridine-3-carboxylic acid
CID 81439910
2-amino-5-(2-ethylphenoxy)pyridine-4-carboxylic acid
CID 114195655
methyl 5-amino-2-[(2-methyl-3-pyridinyl)amino]benzoate
CID 79043332
2-amino-5-chloro-N-(2-methyl-3-pyridinyl)pyridine-4-carboxamide
CID 114923980
methyl 6-amino-4-ethoxypyridine-3-carboxylate
CID 155437022
methyl 2-amino-5-(2,4-difluorophenyl)pyridine-4-carboxylate
CID 172649615
methyl 2-amino-5-(2-ethylphenyl)pyridine-4-carboxylate
CID 172649580

Frequently Asked Questions

What is the IUPAC name of methyl 2-amino-5-[(2-methyl-3-pyridinyl)oxy]pyridine-4-carboxylate?
The IUPAC name of methyl 2-amino-5-[(2-methyl-3-pyridinyl)oxy]pyridine-4-carboxylate (CID 114195699) is methyl 2-amino-5-[(2-methyl-3-pyridinyl)oxy]pyridine-4-carboxylate.
What is the SMILES notation for methyl 2-amino-5-[(2-methyl-3-pyridinyl)oxy]pyridine-4-carboxylate?
The canonical SMILES for methyl 2-amino-5-[(2-methyl-3-pyridinyl)oxy]pyridine-4-carboxylate is COC(=O)c1cc(N)ncc1Oc1cccnc1C.
What is the InChIKey of methyl 2-amino-5-[(2-methyl-3-pyridinyl)oxy]pyridine-4-carboxylate?
The InChIKey is IWNXYEYBAPHWSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O3/c1-8-10(4-3-5-15-8)19-11-7-16-12(14)6-9(11)13(17)18-2/h3-7H,1-2H3,(H2,14,16).
What are the key properties of methyl 2-amino-5-[(2-methyl-3-pyridinyl)oxy]pyridine-4-carboxylate?
methyl 2-amino-5-[(2-methyl-3-pyridinyl)oxy]pyridine-4-carboxylate has a molecular weight of 259.27 g/mol, XLogP of 1.95, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-amino-5-[(2-methyl-3-pyridinyl)oxy]pyridine-4-carboxylate is sourced from PubChem (CID 114195699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).