(Z)-N-[(2Z)-2-ethylidenepyrimidin-1-yl]ethanimine

C8H11N3 — CID 138618370

IUPAC(Z)-N-[(2Z)-2-ethylidenepyrimidin-1-yl]ethanimine
SMILESC/C=N\N1C=CC=N/C1=C/C
InChIInChI=1S/C8H11N3/c1-3-8-9-6-5-7-11(8)10-4-2/h3-7H,1-2H3/b8-3-,10-4-
InChIKeyCMMZLAZEDYAQBV-OQFVNBCLSA-N
MW149.20 g/mol
LogP1.75
Rot. Bonds1

About (Z)-N-[(2Z)-2-ethylidenepyrimidin-1-yl]ethanimine

(Z)-N-[(2Z)-2-ethylidenepyrimidin-1-yl]ethanimine (PubChem CID 138618370) has the molecular formula C8H11N3 and a molecular weight of 149.20 g/mol. Its IUPAC name is (Z)-N-[(2Z)-2-ethylidenepyrimidin-1-yl]ethanimine.

Molecular Properties

Compound Name(Z)-N-[(2Z)-2-ethylidenepyrimidin-1-yl]ethanimine
PubChem CID138618370
Molecular FormulaC8H11N3
Molecular Weight149.20 g/mol
Exact Mass149.10
IUPAC Name(Z)-N-[(2Z)-2-ethylidenepyrimidin-1-yl]ethanimine
SMILESC/C=N\N1C=CC=N/C1=C/C
InChIInChI=1S/C8H11N3/c1-3-8-9-6-5-7-11(8)10-4-2/h3-7H,1-2H3/b8-3-,10-4-
InChIKeyCMMZLAZEDYAQBV-OQFVNBCLSA-N
XLogP1.75
TPSA27.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.20
LogP ≤ 51.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 (Z)-N-[(2Z)-2-ethylidenepyrimidin-1-yl]ethanimine?
The IUPAC name of (Z)-N-[(2Z)-2-ethylidenepyrimidin-1-yl]ethanimine (CID 138618370) is (Z)-N-[(2Z)-2-ethylidenepyrimidin-1-yl]ethanimine.
What is the SMILES notation for (Z)-N-[(2Z)-2-ethylidenepyrimidin-1-yl]ethanimine?
The canonical SMILES for (Z)-N-[(2Z)-2-ethylidenepyrimidin-1-yl]ethanimine is C/C=N\N1C=CC=N/C1=C/C.
What is the InChIKey of (Z)-N-[(2Z)-2-ethylidenepyrimidin-1-yl]ethanimine?
The InChIKey is CMMZLAZEDYAQBV-OQFVNBCLSA-N. The full InChI is InChI=1S/C8H11N3/c1-3-8-9-6-5-7-11(8)10-4-2/h3-7H,1-2H3/b8-3-,10-4-.
What are the key properties of (Z)-N-[(2Z)-2-ethylidenepyrimidin-1-yl]ethanimine?
(Z)-N-[(2Z)-2-ethylidenepyrimidin-1-yl]ethanimine has a molecular weight of 149.20 g/mol, XLogP of 1.75, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-[(2Z)-2-ethylidenepyrimidin-1-yl]ethanimine is sourced from PubChem (CID 138618370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).