morpholin-4-yl(pyrazin-2-yl)methanimine

C9H12N4O — CID 63179816

IUPACmorpholin-4-yl(pyrazin-2-yl)methanimine
SMILES[H]/N=C(\c1cnccn1)N1CCOCC1
InChIInChI=1S/C9H12N4O/c10-9(8-7-11-1-2-12-8)13-3-5-14-6-4-13/h1-2,7,10H,3-6H2/b10-9+
InChIKeyPTRKKJUSMIKEBO-MDZDMXLPSA-N
MW192.22 g/mol
LogP0.13
Rot. Bonds1

About morpholin-4-yl(pyrazin-2-yl)methanimine

morpholin-4-yl(pyrazin-2-yl)methanimine (PubChem CID 63179816) has the molecular formula C9H12N4O and a molecular weight of 192.22 g/mol. Its IUPAC name is morpholin-4-yl(pyrazin-2-yl)methanimine.

Molecular Properties

Compound Namemorpholin-4-yl(pyrazin-2-yl)methanimine
PubChem CID63179816
Molecular FormulaC9H12N4O
Molecular Weight192.22 g/mol
Exact Mass192.10
IUPAC Namemorpholin-4-yl(pyrazin-2-yl)methanimine
SMILES[H]/N=C(\c1cnccn1)N1CCOCC1
InChIInChI=1S/C9H12N4O/c10-9(8-7-11-1-2-12-8)13-3-5-14-6-4-13/h1-2,7,10H,3-6H2/b10-9+
InChIKeyPTRKKJUSMIKEBO-MDZDMXLPSA-N
XLogP0.13
TPSA62.10 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.22
LogP ≤ 50.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl(pyrazin-2-yl)methanimine?
The IUPAC name of morpholin-4-yl(pyrazin-2-yl)methanimine (CID 63179816) is morpholin-4-yl(pyrazin-2-yl)methanimine.
What is the SMILES notation for morpholin-4-yl(pyrazin-2-yl)methanimine?
The canonical SMILES for morpholin-4-yl(pyrazin-2-yl)methanimine is [H]/N=C(\c1cnccn1)N1CCOCC1.
What is the InChIKey of morpholin-4-yl(pyrazin-2-yl)methanimine?
The InChIKey is PTRKKJUSMIKEBO-MDZDMXLPSA-N. The full InChI is InChI=1S/C9H12N4O/c10-9(8-7-11-1-2-12-8)13-3-5-14-6-4-13/h1-2,7,10H,3-6H2/b10-9+.
What are the key properties of morpholin-4-yl(pyrazin-2-yl)methanimine?
morpholin-4-yl(pyrazin-2-yl)methanimine has a molecular weight of 192.22 g/mol, XLogP of 0.13, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl(pyrazin-2-yl)methanimine is sourced from PubChem (CID 63179816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).