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

C9H7N5O — CID 81341848

IUPAC5-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazine-2-carbonitrile
SMILESCc1cc(Oc2cnc(C#N)cn2)n[nH]1
InChIInChI=1S/C9H7N5O/c1-6-2-8(14-13-6)15-9-5-11-7(3-10)4-12-9/h2,4-5H,1H3,(H,13,14)
InChIKeyGPGQCJKYKJUGPE-UHFFFAOYSA-N
MW201.19 g/mol
LogP1.17
Rot. Bonds2

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

5-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazine-2-carbonitrile (PubChem CID 81341848) has the molecular formula C9H7N5O and a molecular weight of 201.19 g/mol. Its IUPAC name is 5-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazine-2-carbonitrile.

Molecular Properties

Compound Name5-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazine-2-carbonitrile
PubChem CID81341848
Molecular FormulaC9H7N5O
Molecular Weight201.19 g/mol
Exact Mass201.07
IUPAC Name5-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazine-2-carbonitrile
SMILESCc1cc(Oc2cnc(C#N)cn2)n[nH]1
InChIInChI=1S/C9H7N5O/c1-6-2-8(14-13-6)15-9-5-11-7(3-10)4-12-9/h2,4-5H,1H3,(H,13,14)
InChIKeyGPGQCJKYKJUGPE-UHFFFAOYSA-N
XLogP1.17
TPSA87.48 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.19
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazine-2-carbonitrile with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazine-2-carbonitrile?
The IUPAC name of 5-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazine-2-carbonitrile (CID 81341848) is 5-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazine-2-carbonitrile.
What is the SMILES notation for 5-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazine-2-carbonitrile?
The canonical SMILES for 5-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazine-2-carbonitrile is Cc1cc(Oc2cnc(C#N)cn2)n[nH]1.
What is the InChIKey of 5-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazine-2-carbonitrile?
The InChIKey is GPGQCJKYKJUGPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7N5O/c1-6-2-8(14-13-6)15-9-5-11-7(3-10)4-12-9/h2,4-5H,1H3,(H,13,14).
What are the key properties of 5-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazine-2-carbonitrile?
5-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazine-2-carbonitrile has a molecular weight of 201.19 g/mol, XLogP of 1.17, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazine-2-carbonitrile is sourced from PubChem (CID 81341848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).