Methyl 5-(6-ethoxy-4-methoxy-3-pyridinyl)-1-methylpyrazole-3-carboxylate

Name: Methyl 5-(6-ethoxy-4-methoxy-3-pyridinyl)-1-methylpyrazole-3-carboxylate — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₄H₁₇N₃O₄ — CID 118130839

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPACmethyl 5-(6-ethoxy-4-methoxy-3-pyridinyl)-1-methylpyrazole-3-carboxylate

SMILESCCOc1cc(OC)c(-c2cc(C(=O)OC)nn2C)cn1

InChIInChI=1S/C14H17N3O4/c1-5-21-13-7-12(19-3)9(8-15-13)11-6-10(14(18)20-4)16-17(11)2/h6-8H,5H2,1-4H3

InChIKeyJMQPCKJZJUDZDA-UHFFFAOYSA-N

MW291.31 g/mol

LogP1.68

Rot. Bonds5

About Methyl 5-(6-ethoxy-4-methoxy-3-pyridinyl)-1-methylpyrazole-3-carboxylate

Methyl 5-(6-ethoxy-4-methoxy-3-pyridinyl)-1-methylpyrazole-3-carboxylate (PubChem CID 118130839) has the molecular formula C₁₄H₁₇N₃O₄ and a molecular weight of 291.31 g/mol. Its IUPAC name is methyl 5-(6-ethoxy-4-methoxy-3-pyridinyl)-1-methylpyrazole-3-carboxylate.

Molecular Properties

Compound Name	Methyl 5-(6-ethoxy-4-methoxy-3-pyridinyl)-1-methylpyrazole-3-carboxylate
PubChem CID	118130839
Molecular Formula	C₁₄H₁₇N₃O₄
Molecular Weight	291.31 g/mol
Exact Mass	291.12
IUPAC Name	methyl 5-(6-ethoxy-4-methoxy-3-pyridinyl)-1-methylpyrazole-3-carboxylate
SMILES	CCOc1cc(OC)c(-c2cc(C(=O)OC)nn2C)cn1
InChI	InChI=1S/C14H17N3O4/c1-5-21-13-7-12(19-3)9(8-15-13)11-6-10(14(18)20-4)16-17(11)2/h6-8H,5H2,1-4H3
InChIKey	JMQPCKJZJUDZDA-UHFFFAOYSA-N
XLogP	1.68
TPSA	75.47 Å²
H-Bond Donors
H-Bond Acceptors	7
Rotatable Bonds	5
Heavy Atoms	21
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	291.31
LogP ≤ 5	1.68
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of Methyl 5-(6-ethoxy-4-methoxy-3-pyridinyl)-1-methylpyrazole-3-carboxylate?

The IUPAC name of Methyl 5-(6-ethoxy-4-methoxy-3-pyridinyl)-1-methylpyrazole-3-carboxylate (CID 118130839) is methyl 5-(6-ethoxy-4-methoxy-3-pyridinyl)-1-methylpyrazole-3-carboxylate.

What is the SMILES notation for Methyl 5-(6-ethoxy-4-methoxy-3-pyridinyl)-1-methylpyrazole-3-carboxylate?

The canonical SMILES for Methyl 5-(6-ethoxy-4-methoxy-3-pyridinyl)-1-methylpyrazole-3-carboxylate is CCOc1cc(OC)c(-c2cc(C(=O)OC)nn2C)cn1.

What is the InChIKey of Methyl 5-(6-ethoxy-4-methoxy-3-pyridinyl)-1-methylpyrazole-3-carboxylate?

The InChIKey is JMQPCKJZJUDZDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O4/c1-5-21-13-7-12(19-3)9(8-15-13)11-6-10(14(18)20-4)16-17(11)2/h6-8H,5H2,1-4H3.

What are the key properties of Methyl 5-(6-ethoxy-4-methoxy-3-pyridinyl)-1-methylpyrazole-3-carboxylate?

Methyl 5-(6-ethoxy-4-methoxy-3-pyridinyl)-1-methylpyrazole-3-carboxylate has a molecular weight of 291.31 g/mol, XLogP of 1.68, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for Methyl 5-(6-ethoxy-4-methoxy-3-pyridinyl)-1-methylpyrazole-3-carboxylate is sourced from PubChem (CID 118130839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 118130839 — identifiers, structure, computed properties (public domain)

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