1-pyrazin-2-yl-N-(pyrazin-2-ylmethyl)methanimine

C10H9N5 — CID 162411575

IUPAC1-pyrazin-2-yl-N-(pyrazin-2-ylmethyl)methanimine
SMILESC(=N/Cc1cnccn1)\c1cnccn1
InChIInChI=1S/C10H9N5/c1-3-14-9(5-11-1)7-13-8-10-6-12-2-4-15-10/h1-7H,8H2/b13-7+
InChIKeyQSMQOLBYEVZPAF-NTUHNPAUSA-N
MW199.22 g/mol
LogP0.89
Rot. Bonds3

About 1-pyrazin-2-yl-N-(pyrazin-2-ylmethyl)methanimine

1-pyrazin-2-yl-N-(pyrazin-2-ylmethyl)methanimine (PubChem CID 162411575) has the molecular formula C10H9N5 and a molecular weight of 199.22 g/mol. Its IUPAC name is 1-pyrazin-2-yl-N-(pyrazin-2-ylmethyl)methanimine.

Molecular Properties

Compound Name1-pyrazin-2-yl-N-(pyrazin-2-ylmethyl)methanimine
PubChem CID162411575
Molecular FormulaC10H9N5
Molecular Weight199.22 g/mol
Exact Mass199.09
IUPAC Name1-pyrazin-2-yl-N-(pyrazin-2-ylmethyl)methanimine
SMILESC(=N/Cc1cnccn1)\c1cnccn1
InChIInChI=1S/C10H9N5/c1-3-14-9(5-11-1)7-13-8-10-6-12-2-4-15-10/h1-7H,8H2/b13-7+
InChIKeyQSMQOLBYEVZPAF-NTUHNPAUSA-N
XLogP0.89
TPSA63.92 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.22
LogP ≤ 50.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-pyrazin-2-yl-N-(pyrazin-2-ylmethyl)methanimine?
The IUPAC name of 1-pyrazin-2-yl-N-(pyrazin-2-ylmethyl)methanimine (CID 162411575) is 1-pyrazin-2-yl-N-(pyrazin-2-ylmethyl)methanimine.
What is the SMILES notation for 1-pyrazin-2-yl-N-(pyrazin-2-ylmethyl)methanimine?
The canonical SMILES for 1-pyrazin-2-yl-N-(pyrazin-2-ylmethyl)methanimine is C(=N/Cc1cnccn1)\c1cnccn1.
What is the InChIKey of 1-pyrazin-2-yl-N-(pyrazin-2-ylmethyl)methanimine?
The InChIKey is QSMQOLBYEVZPAF-NTUHNPAUSA-N. The full InChI is InChI=1S/C10H9N5/c1-3-14-9(5-11-1)7-13-8-10-6-12-2-4-15-10/h1-7H,8H2/b13-7+.
What are the key properties of 1-pyrazin-2-yl-N-(pyrazin-2-ylmethyl)methanimine?
1-pyrazin-2-yl-N-(pyrazin-2-ylmethyl)methanimine has a molecular weight of 199.22 g/mol, XLogP of 0.89, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyrazin-2-yl-N-(pyrazin-2-ylmethyl)methanimine is sourced from PubChem (CID 162411575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).