methyl 4-(5-amino-2-methylphenoxy)pyridine-2-carboxylate

C14H14N2O3 — CID 66284886

IUPACmethyl 4-(5-amino-2-methylphenoxy)pyridine-2-carboxylate
SMILESCOC(=O)c1cc(Oc2cc(N)ccc2C)ccn1
InChIInChI=1S/C14H14N2O3/c1-9-3-4-10(15)7-13(9)19-11-5-6-16-12(8-11)14(17)18-2/h3-8H,15H2,1-2H3
InChIKeyFQZXMENNTNJNLX-UHFFFAOYSA-N
MW258.28 g/mol
LogP2.55
Rot. Bonds3

About methyl 4-(5-amino-2-methylphenoxy)pyridine-2-carboxylate

methyl 4-(5-amino-2-methylphenoxy)pyridine-2-carboxylate (PubChem CID 66284886) has the molecular formula C14H14N2O3 and a molecular weight of 258.28 g/mol. Its IUPAC name is methyl 4-(5-amino-2-methylphenoxy)pyridine-2-carboxylate.

Molecular Properties

Compound Namemethyl 4-(5-amino-2-methylphenoxy)pyridine-2-carboxylate
PubChem CID66284886
Molecular FormulaC14H14N2O3
Molecular Weight258.28 g/mol
Exact Mass258.10
IUPAC Namemethyl 4-(5-amino-2-methylphenoxy)pyridine-2-carboxylate
SMILESCOC(=O)c1cc(Oc2cc(N)ccc2C)ccn1
InChIInChI=1S/C14H14N2O3/c1-9-3-4-10(15)7-13(9)19-11-5-6-16-12(8-11)14(17)18-2/h3-8H,15H2,1-2H3
InChIKeyFQZXMENNTNJNLX-UHFFFAOYSA-N
XLogP2.55
TPSA74.44 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

methyl 4-aminopyridine-2-carboxylate
CID 3759117
4-(4-aminophenoxy)-N-methylpyridine-2-carboxamide;methyl 4-(4-aminophenoxy)pyridine-2-carboxylate
CID 162090161
methyl 4-(2-amino-4-bromophenoxy)pyridine-2-carboxylate
CID 66287690
ethene;methyl 4-aminopyridine-2-carboxylate
CID 177218086
methyl 4-(4-amino-3-fluorophenoxy)pyridine-2-carboxylate
CID 23153051
4-(5-hydrazinyl-2-methylphenoxy)-N-methylpyridine-2-carboxamide
CID 86069287
4-(5-amino-2-bromophenoxy)pyridine-2-carboxamide
CID 103011692
methyl 4-(2-aminoethoxy)pyridine-2-carboxylate
CID 66286147
methyl 4-[3-(aminomethyl)phenoxy]pyridine-2-carboxylate
CID 106485855
methyl 4-methylpyridine-2-carboxylate
CID 10920693
methyl 4-(1,2,3,4-tetrahydroquinolin-8-yloxy)pyridine-2-carboxylate
CID 66286325
4-(5-bromo-2-methylphenoxy)-N-ethylpyridine-2-carboxamide
CID 107284547

Frequently Asked Questions

What is the IUPAC name of methyl 4-(5-amino-2-methylphenoxy)pyridine-2-carboxylate?
The IUPAC name of methyl 4-(5-amino-2-methylphenoxy)pyridine-2-carboxylate (CID 66284886) is methyl 4-(5-amino-2-methylphenoxy)pyridine-2-carboxylate.
What is the SMILES notation for methyl 4-(5-amino-2-methylphenoxy)pyridine-2-carboxylate?
The canonical SMILES for methyl 4-(5-amino-2-methylphenoxy)pyridine-2-carboxylate is COC(=O)c1cc(Oc2cc(N)ccc2C)ccn1.
What is the InChIKey of methyl 4-(5-amino-2-methylphenoxy)pyridine-2-carboxylate?
The InChIKey is FQZXMENNTNJNLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O3/c1-9-3-4-10(15)7-13(9)19-11-5-6-16-12(8-11)14(17)18-2/h3-8H,15H2,1-2H3.
What are the key properties of methyl 4-(5-amino-2-methylphenoxy)pyridine-2-carboxylate?
methyl 4-(5-amino-2-methylphenoxy)pyridine-2-carboxylate has a molecular weight of 258.28 g/mol, XLogP of 2.55, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 4-(5-amino-2-methylphenoxy)pyridine-2-carboxylate is sourced from PubChem (CID 66284886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).