N-(4-methylpent-2-en-2-yl)ethanimine;yttrium

C8H13NY-2 — CID 59148080

IUPACN-(4-methylpent-2-en-2-yl)ethanimine;yttrium
SMILESC/[C-]=N/C(C)=[C-]/C(C)C.[Y]
InChIInChI=1S/C8H13N.Y/c1-5-9-8(4)6-7(2)3;/h7H,1-4H3;/q-2;
InChIKeyOMLAFCMHZXYBES-UHFFFAOYSA-N
MW212.10 g/mol
LogP2.31
Rot. Bonds2

About N-(4-methylpent-2-en-2-yl)ethanimine;yttrium

N-(4-methylpent-2-en-2-yl)ethanimine;yttrium (PubChem CID 59148080) has the molecular formula C8H13NY-2 and a molecular weight of 212.10 g/mol. Its IUPAC name is N-(4-methylpent-2-en-2-yl)ethanimine;yttrium.

Molecular Properties

Compound NameN-(4-methylpent-2-en-2-yl)ethanimine;yttrium
PubChem CID59148080
Molecular FormulaC8H13NY-2
Molecular Weight212.10 g/mol
Exact Mass212.01
IUPAC NameN-(4-methylpent-2-en-2-yl)ethanimine;yttrium
SMILESC/[C-]=N/C(C)=[C-]/C(C)C.[Y]
InChIInChI=1S/C8H13N.Y/c1-5-9-8(4)6-7(2)3;/h7H,1-4H3;/q-2;
InChIKeyOMLAFCMHZXYBES-UHFFFAOYSA-N
XLogP2.31
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.10
LogP ≤ 52.31
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-(4-methylpent-2-en-2-yl)ethanimine;yttrium with MolForge

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

Launch Full Analysis

Related Compounds

N-(2,2,5,5-tetramethylhex-3-en-3-yl)ethanimine;vanadium(2+)
CID 18719741
CID 19803292
CID 19803292
4,5-Dimethyl-2,3-dihydropyrrol-2-ide;yttrium
CID 59009700
N-pent-2-en-3-ylethanimine;yttrium
CID 59989676
2,2-dimethyl-N-(2,2,5,5-tetramethylhex-3-en-3-yl)propan-1-imine;yttrium
CID 60024113
N-(2,4-dimethylpent-2-en-3-yl)propan-2-imine
CID 126603650
N-(4,4-dimethylpent-2-en-3-yl)-2,2-dimethylpropan-1-imine;yttrium
CID 167377208

Frequently Asked Questions

What is the IUPAC name of N-(4-methylpent-2-en-2-yl)ethanimine;yttrium?
The IUPAC name of N-(4-methylpent-2-en-2-yl)ethanimine;yttrium (CID 59148080) is N-(4-methylpent-2-en-2-yl)ethanimine;yttrium.
What is the SMILES notation for N-(4-methylpent-2-en-2-yl)ethanimine;yttrium?
The canonical SMILES for N-(4-methylpent-2-en-2-yl)ethanimine;yttrium is C/[C-]=N/C(C)=[C-]/C(C)C.[Y].
What is the InChIKey of N-(4-methylpent-2-en-2-yl)ethanimine;yttrium?
The InChIKey is OMLAFCMHZXYBES-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N.Y/c1-5-9-8(4)6-7(2)3;/h7H,1-4H3;/q-2;.
What are the key properties of N-(4-methylpent-2-en-2-yl)ethanimine;yttrium?
N-(4-methylpent-2-en-2-yl)ethanimine;yttrium has a molecular weight of 212.10 g/mol, XLogP of 2.31, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylpent-2-en-2-yl)ethanimine;yttrium is sourced from PubChem (CID 59148080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).