N-prop-1-en-2-ylprop-2-en-1-imine;yttrium

C₆H₈NY- — CID 155716860

About N-prop-1-en-2-ylprop-2-en-1-imine;yttrium

N-prop-1-en-2-ylprop-2-en-1-imine;yttrium (PubChem CID 155716860) has the molecular formula C₆H₈NY- and a molecular weight of 183.04 g/mol. Its IUPAC name is N-prop-1-en-2-ylprop-2-en-1-imine;yttrium.

Molecular Properties

• Compound Name: N-prop-1-en-2-ylprop-2-en-1-imine;yttrium
• PubChem CID: 155716860
• Molecular Formula: C₆H₈NY-
• Molecular Weight: 183.04 g/mol
• Exact Mass: 182.97
• IUPAC Name: N-prop-1-en-2-ylprop-2-en-1-imine;yttrium
• SMILES: C=C/[C-]=N/C(=C)C.[Y]
• InChI: InChI=1S/C6H8N.Y/c1-4-5-7-6(2)3;/h4H,1-2H2,3H3;/q-1
• InChIKey: SRYGTNDMWBJUOZ-UHFFFAOYSA-N
• XLogP: 1.65
• TPSA: 12.36 Ų
• H-Bond Acceptors: 1
• Rotatable Bonds: 2
• Heavy Atoms: 8
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	183.04
LogP ≤ 5	1.65
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	1

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-prop-1-en-2-ylprop-2-en-1-imine;yttrium?

The IUPAC name of N-prop-1-en-2-ylprop-2-en-1-imine;yttrium (CID 155716860) is N-prop-1-en-2-ylprop-2-en-1-imine;yttrium.

What is the SMILES notation for N-prop-1-en-2-ylprop-2-en-1-imine;yttrium?

The canonical SMILES for N-prop-1-en-2-ylprop-2-en-1-imine;yttrium is C=C/[C-]=N/C(=C)C.[Y].

What is the InChIKey of N-prop-1-en-2-ylprop-2-en-1-imine;yttrium?

The InChIKey is SRYGTNDMWBJUOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N.Y/c1-4-5-7-6(2)3;/h4H,1-2H2,3H3;/q-1;.

What are the key properties of N-prop-1-en-2-ylprop-2-en-1-imine;yttrium?

N-prop-1-en-2-ylprop-2-en-1-imine;yttrium has a molecular weight of 183.04 g/mol, XLogP of 1.65, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.

Where does this data come from?

All data for N-prop-1-en-2-ylprop-2-en-1-imine;yttrium is sourced from PubChem (CID 155716860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 155716860 — identifiers, structure, computed properties (public domain)

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