[6-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazin-2-yl]methanamine

C9H11N5O — CID 81342057

IUPAC[6-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazin-2-yl]methanamine
SMILESCc1cc(Oc2cncc(CN)n2)n[nH]1
InChIInChI=1S/C9H11N5O/c1-6-2-8(14-13-6)15-9-5-11-4-7(3-10)12-9/h2,4-5H,3,10H2,1H3,(H,13,14)
InChIKeyVELGOCAKIVOBJL-UHFFFAOYSA-N
MW205.22 g/mol
LogP0.76
Rot. Bonds3

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

[6-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazin-2-yl]methanamine (PubChem CID 81342057) has the molecular formula C9H11N5O and a molecular weight of 205.22 g/mol. Its IUPAC name is [6-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazin-2-yl]methanamine.

Molecular Properties

Compound Name[6-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazin-2-yl]methanamine
PubChem CID81342057
Molecular FormulaC9H11N5O
Molecular Weight205.22 g/mol
Exact Mass205.10
IUPAC Name[6-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazin-2-yl]methanamine
SMILESCc1cc(Oc2cncc(CN)n2)n[nH]1
InChIInChI=1S/C9H11N5O/c1-6-2-8(14-13-6)15-9-5-11-4-7(3-10)12-9/h2,4-5H,3,10H2,1H3,(H,13,14)
InChIKeyVELGOCAKIVOBJL-UHFFFAOYSA-N
XLogP0.76
TPSA89.71 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [6-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazin-2-yl]methanamine?
The IUPAC name of [6-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazin-2-yl]methanamine (CID 81342057) is [6-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazin-2-yl]methanamine.
What is the SMILES notation for [6-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazin-2-yl]methanamine?
The canonical SMILES for [6-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazin-2-yl]methanamine is Cc1cc(Oc2cncc(CN)n2)n[nH]1.
What is the InChIKey of [6-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazin-2-yl]methanamine?
The InChIKey is VELGOCAKIVOBJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N5O/c1-6-2-8(14-13-6)15-9-5-11-4-7(3-10)12-9/h2,4-5H,3,10H2,1H3,(H,13,14).
What are the key properties of [6-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazin-2-yl]methanamine?
[6-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazin-2-yl]methanamine has a molecular weight of 205.22 g/mol, XLogP of 0.76, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[(5-methyl-1H-pyrazol-3-yl)oxy]pyrazin-2-yl]methanamine is sourced from PubChem (CID 81342057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).