methyl 3-amino-2-(2,5-dimethylpyrazol-3-yl)oxypyridine-4-carboxylate

C12H14N4O3 — CID 81346232

IUPACmethyl 3-amino-2-(2,5-dimethylpyrazol-3-yl)oxypyridine-4-carboxylate
SMILESCOC(=O)c1ccnc(Oc2cc(C)nn2C)c1N
InChIInChI=1S/C12H14N4O3/c1-7-6-9(16(2)15-7)19-11-10(13)8(4-5-14-11)12(17)18-3/h4-6H,13H2,1-3H3
InChIKeyMNLVJXINSDGNRN-UHFFFAOYSA-N
MW262.27 g/mol
LogP1.28
Rot. Bonds3

About methyl 3-amino-2-(2,5-dimethylpyrazol-3-yl)oxypyridine-4-carboxylate

methyl 3-amino-2-(2,5-dimethylpyrazol-3-yl)oxypyridine-4-carboxylate (PubChem CID 81346232) has the molecular formula C12H14N4O3 and a molecular weight of 262.27 g/mol. Its IUPAC name is methyl 3-amino-2-(2,5-dimethylpyrazol-3-yl)oxypyridine-4-carboxylate.

Molecular Properties

Compound Namemethyl 3-amino-2-(2,5-dimethylpyrazol-3-yl)oxypyridine-4-carboxylate
PubChem CID81346232
Molecular FormulaC12H14N4O3
Molecular Weight262.27 g/mol
Exact Mass262.11
IUPAC Namemethyl 3-amino-2-(2,5-dimethylpyrazol-3-yl)oxypyridine-4-carboxylate
SMILESCOC(=O)c1ccnc(Oc2cc(C)nn2C)c1N
InChIInChI=1S/C12H14N4O3/c1-7-6-9(16(2)15-7)19-11-10(13)8(4-5-14-11)12(17)18-3/h4-6H,13H2,1-3H3
InChIKeyMNLVJXINSDGNRN-UHFFFAOYSA-N
XLogP1.28
TPSA92.26 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.27
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

methyl 2-amino-5-(2,5-dimethylpyrazol-3-yl)oxy-3-methylbenzoate
CID 81341337
2-(2,5-dimethylpyrazol-3-yl)oxypyridine-3-carboxylic acid
CID 81342189
methyl 3-amino-2-(5-bromo-2-methylphenoxy)pyridine-4-carboxylate
CID 107285352
3-chloro-2-(2,5-dimethylpyrazol-3-yl)oxy-N'-hydroxypyridine-4-carboximidamide
CID 136739765
methyl 3-amino-2-(1-propan-2-ylpyrazol-4-yl)oxypyridine-4-carboxylate
CID 116802609
2-(2,5-dimethylpyrazol-3-yl)oxypyridine-3-sulfonamide
CID 112573130
methyl 3-amino-2-[2-(2-hydroxyethyl)phenoxy]pyridine-4-carboxylate
CID 107713848
4-(2,5-dimethylpyrazol-3-yl)oxypyrimidin-2-amine
CID 81346798
1-[2-amino-5-(2,5-dimethylpyrazol-3-yl)oxyphenyl]ethanone
CID 104613349
methyl 3-amino-2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pyridine-4-carboxylate
CID 112588507
4-amino-3-(2,5-dimethylpyrazol-3-yl)oxy-N-methylbenzamide
CID 81342274
2-amino-5-(2,5-dimethylpyrazol-3-yl)oxypyridine-4-carboxylic acid
CID 114195702

Frequently Asked Questions

What is the IUPAC name of methyl 3-amino-2-(2,5-dimethylpyrazol-3-yl)oxypyridine-4-carboxylate?
The IUPAC name of methyl 3-amino-2-(2,5-dimethylpyrazol-3-yl)oxypyridine-4-carboxylate (CID 81346232) is methyl 3-amino-2-(2,5-dimethylpyrazol-3-yl)oxypyridine-4-carboxylate.
What is the SMILES notation for methyl 3-amino-2-(2,5-dimethylpyrazol-3-yl)oxypyridine-4-carboxylate?
The canonical SMILES for methyl 3-amino-2-(2,5-dimethylpyrazol-3-yl)oxypyridine-4-carboxylate is COC(=O)c1ccnc(Oc2cc(C)nn2C)c1N.
What is the InChIKey of methyl 3-amino-2-(2,5-dimethylpyrazol-3-yl)oxypyridine-4-carboxylate?
The InChIKey is MNLVJXINSDGNRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O3/c1-7-6-9(16(2)15-7)19-11-10(13)8(4-5-14-11)12(17)18-3/h4-6H,13H2,1-3H3.
What are the key properties of methyl 3-amino-2-(2,5-dimethylpyrazol-3-yl)oxypyridine-4-carboxylate?
methyl 3-amino-2-(2,5-dimethylpyrazol-3-yl)oxypyridine-4-carboxylate has a molecular weight of 262.27 g/mol, XLogP of 1.28, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 3-amino-2-(2,5-dimethylpyrazol-3-yl)oxypyridine-4-carboxylate is sourced from PubChem (CID 81346232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).