N-but-2-en-2-ylethanimine;yttrium

C6H9NY-2 — CID 59962030

IUPACN-but-2-en-2-ylethanimine;yttrium
SMILESC/[C-]=N/C(C)=[C-]/C.[Y]
InChIInChI=1S/C6H9N.Y/c1-4-6(3)7-5-2;/h1-3H3;/q-2;
InChIKeyWUWWXUCPZXDVBV-UHFFFAOYSA-N
MW184.05 g/mol
LogP1.68
Rot. Bonds1

About N-but-2-en-2-ylethanimine;yttrium

N-but-2-en-2-ylethanimine;yttrium (PubChem CID 59962030) has the molecular formula C6H9NY-2 and a molecular weight of 184.05 g/mol. Its IUPAC name is N-but-2-en-2-ylethanimine;yttrium.

Molecular Properties

Compound NameN-but-2-en-2-ylethanimine;yttrium
PubChem CID59962030
Molecular FormulaC6H9NY-2
Molecular Weight184.05 g/mol
Exact Mass183.98
IUPAC NameN-but-2-en-2-ylethanimine;yttrium
SMILESC/[C-]=N/C(C)=[C-]/C.[Y]
InChIInChI=1S/C6H9N.Y/c1-4-6(3)7-5-2;/h1-3H3;/q-2;
InChIKeyWUWWXUCPZXDVBV-UHFFFAOYSA-N
XLogP1.68
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.05
LogP ≤ 51.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-but-2-en-2-ylethanimine;yttrium?
The IUPAC name of N-but-2-en-2-ylethanimine;yttrium (CID 59962030) is N-but-2-en-2-ylethanimine;yttrium.
What is the SMILES notation for N-but-2-en-2-ylethanimine;yttrium?
The canonical SMILES for N-but-2-en-2-ylethanimine;yttrium is C/[C-]=N/C(C)=[C-]/C.[Y].
What is the InChIKey of N-but-2-en-2-ylethanimine;yttrium?
The InChIKey is WUWWXUCPZXDVBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N.Y/c1-4-6(3)7-5-2;/h1-3H3;/q-2;.
What are the key properties of N-but-2-en-2-ylethanimine;yttrium?
N-but-2-en-2-ylethanimine;yttrium has a molecular weight of 184.05 g/mol, XLogP of 1.68, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-but-2-en-2-ylethanimine;yttrium is sourced from PubChem (CID 59962030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).