methyl 6-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazine-2-carboxylate

C10H10N4O3 — CID 81341558

IUPACmethyl 6-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazine-2-carboxylate
SMILESCOC(=O)c1cncc(Oc2cc(C)[nH]n2)n1
InChIInChI=1S/C10H10N4O3/c1-6-3-8(14-13-6)17-9-5-11-4-7(12-9)10(15)16-2/h3-5H,1-2H3,(H,13,14)
InChIKeyMIJVBVIHPAUUIH-UHFFFAOYSA-N
MW234.22 g/mol
LogP1.09
Rot. Bonds3

About methyl 6-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazine-2-carboxylate

methyl 6-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazine-2-carboxylate (PubChem CID 81341558) has the molecular formula C10H10N4O3 and a molecular weight of 234.22 g/mol. Its IUPAC name is methyl 6-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazine-2-carboxylate.

Molecular Properties

Compound Namemethyl 6-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazine-2-carboxylate
PubChem CID81341558
Molecular FormulaC10H10N4O3
Molecular Weight234.22 g/mol
Exact Mass234.08
IUPAC Namemethyl 6-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazine-2-carboxylate
SMILESCOC(=O)c1cncc(Oc2cc(C)[nH]n2)n1
InChIInChI=1S/C10H10N4O3/c1-6-3-8(14-13-6)17-9-5-11-4-7(12-9)10(15)16-2/h3-5H,1-2H3,(H,13,14)
InChIKeyMIJVBVIHPAUUIH-UHFFFAOYSA-N
XLogP1.09
TPSA89.99 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.22
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of methyl 6-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazine-2-carboxylate?
The IUPAC name of methyl 6-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazine-2-carboxylate (CID 81341558) is methyl 6-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazine-2-carboxylate.
What is the SMILES notation for methyl 6-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazine-2-carboxylate?
The canonical SMILES for methyl 6-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazine-2-carboxylate is COC(=O)c1cncc(Oc2cc(C)[nH]n2)n1.
What is the InChIKey of methyl 6-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazine-2-carboxylate?
The InChIKey is MIJVBVIHPAUUIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O3/c1-6-3-8(14-13-6)17-9-5-11-4-7(12-9)10(15)16-2/h3-5H,1-2H3,(H,13,14).
What are the key properties of methyl 6-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazine-2-carboxylate?
methyl 6-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazine-2-carboxylate has a molecular weight of 234.22 g/mol, XLogP of 1.09, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 6-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazine-2-carboxylate is sourced from PubChem (CID 81341558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).