N-ethenyl-2-methylpropan-1-imine;yttrium

C6H9NY-2 — CID 59037954

IUPACN-ethenyl-2-methylpropan-1-imine;yttrium
SMILES[H]/[C-]=C/N=[C-]/C(C)C.[Y]
InChIInChI=1S/C6H9N.Y/c1-4-7-5-6(2)3;/h1,4,6H,2-3H3;/q-2;
InChIKeyWCLIDCSHCCCUMA-UHFFFAOYSA-N
MW184.05 g/mol
LogP1.53
Rot. Bonds2

About N-ethenyl-2-methylpropan-1-imine;yttrium

N-ethenyl-2-methylpropan-1-imine;yttrium (PubChem CID 59037954) has the molecular formula C6H9NY-2 and a molecular weight of 184.05 g/mol. Its IUPAC name is N-ethenyl-2-methylpropan-1-imine;yttrium.

Molecular Properties

Compound NameN-ethenyl-2-methylpropan-1-imine;yttrium
PubChem CID59037954
Molecular FormulaC6H9NY-2
Molecular Weight184.05 g/mol
Exact Mass183.98
IUPAC NameN-ethenyl-2-methylpropan-1-imine;yttrium
SMILES[H]/[C-]=C/N=[C-]/C(C)C.[Y]
InChIInChI=1S/C6H9N.Y/c1-4-7-5-6(2)3;/h1,4,6H,2-3H3;/q-2;
InChIKeyWCLIDCSHCCCUMA-UHFFFAOYSA-N
XLogP1.53
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.05
LogP ≤ 51.53
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'}

Analyze N-ethenyl-2-methylpropan-1-imine;yttrium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-ethenyl-2-methylpropan-1-imine;yttrium?
The IUPAC name of N-ethenyl-2-methylpropan-1-imine;yttrium (CID 59037954) is N-ethenyl-2-methylpropan-1-imine;yttrium.
What is the SMILES notation for N-ethenyl-2-methylpropan-1-imine;yttrium?
The canonical SMILES for N-ethenyl-2-methylpropan-1-imine;yttrium is [H]/[C-]=C/N=[C-]/C(C)C.[Y].
What is the InChIKey of N-ethenyl-2-methylpropan-1-imine;yttrium?
The InChIKey is WCLIDCSHCCCUMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N.Y/c1-4-7-5-6(2)3;/h1,4,6H,2-3H3;/q-2;.
What are the key properties of N-ethenyl-2-methylpropan-1-imine;yttrium?
N-ethenyl-2-methylpropan-1-imine;yttrium has a molecular weight of 184.05 g/mol, XLogP of 1.53, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-2-methylpropan-1-imine;yttrium is sourced from PubChem (CID 59037954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).