3-but-2-en-2-yl-5-methyl-2H-imidazol-2-id-4-amine;1-but-2-en-2-yl-4-methyl-2H-imidazol-2-ide;1-(4,5-dimethyl-2H-imidazol-2-id-1-yl)prop-1-en-1-amine;4,5-dimethyl-1-prop-1-enyl-2H-imidazol-2-ide;tetrakis(yttrium)

C32H42N10Y4-8 — CID 159646891

IUPAC3-but-2-en-2-yl-5-methyl-2H-imidazol-2-id-4-amine;1-but-2-en-2-yl-4-methyl-2H-imidazol-2-ide;1-(4,5-dimethyl-2H-imidazol-2-id-1-yl)prop-1-en-1-amine;4,5-dimethyl-1-prop-1-enyl-2H-imidazol-2-ide;tetrakis(yttrium)
SMILESC/[C-]=C(\C)n1[c-]nc(C)c1.C/[C-]=C(\C)n1[c-]nc(C)c1N.C/[C-]=C(\N)n1[c-]nc(C)c1C.C/[C-]=C/n1[c-]nc(C)c1C.[Y].[Y].[Y].[Y]
InChIInChI=1S/2C8H11N3.2C8H10N2.4Y/c1-4-8(9)11-5-10-6(2)7(11)3;1-4-6(2)11-5-10-7(3)8(11)9;1-4-8(3)10-5-7(2)9-6-10;1-4-5-10-6-9-7(2)8(10)3;;;;/h2*9H2,1-3H3;2*5H,1-3H3;;;;/q4*-2;;;;
InChIKeyQHGKZZLZKMRGPH-UHFFFAOYSA-N
MW922.38 g/mol
LogP5.40
Rot. Bonds4

About 3-but-2-en-2-yl-5-methyl-2H-imidazol-2-id-4-amine;1-but-2-en-2-yl-4-methyl-2H-imidazol-2-ide;1-(4,5-dimethyl-2H-imidazol-2-id-1-yl)prop-1-en-1-amine;4,5-dimethyl-1-prop-1-enyl-2H-imidazol-2-ide;tetrakis(yttrium)

3-but-2-en-2-yl-5-methyl-2H-imidazol-2-id-4-amine;1-but-2-en-2-yl-4-methyl-2H-imidazol-2-ide;1-(4,5-dimethyl-2H-imidazol-2-id-1-yl)prop-1-en-1-amine;4,5-dimethyl-1-prop-1-enyl-2H-imidazol-2-ide;tetrakis(yttrium) (PubChem CID 159646891) has the molecular formula C32H42N10Y4-8 and a molecular weight of 922.38 g/mol. Its IUPAC name is 3-but-2-en-2-yl-5-methyl-2H-imidazol-2-id-4-amine;1-but-2-en-2-yl-4-methyl-2H-imidazol-2-ide;1-(4,5-dimethyl-2H-imidazol-2-id-1-yl)prop-1-en-1-amine;4,5-dimethyl-1-prop-1-enyl-2H-imidazol-2-ide;tetrakis(yttrium).

Molecular Properties

Compound Name3-but-2-en-2-yl-5-methyl-2H-imidazol-2-id-4-amine;1-but-2-en-2-yl-4-methyl-2H-imidazol-2-ide;1-(4,5-dimethyl-2H-imidazol-2-id-1-yl)prop-1-en-1-amine;4,5-dimethyl-1-prop-1-enyl-2H-imidazol-2-ide;tetrakis(yttrium)
PubChem CID159646891
Molecular FormulaC32H42N10Y4-8
Molecular Weight922.38 g/mol
Exact Mass921.99
IUPAC Name3-but-2-en-2-yl-5-methyl-2H-imidazol-2-id-4-amine;1-but-2-en-2-yl-4-methyl-2H-imidazol-2-ide;1-(4,5-dimethyl-2H-imidazol-2-id-1-yl)prop-1-en-1-amine;4,5-dimethyl-1-prop-1-enyl-2H-imidazol-2-ide;tetrakis(yttrium)
SMILESC/[C-]=C(\C)n1[c-]nc(C)c1.C/[C-]=C(\C)n1[c-]nc(C)c1N.C/[C-]=C(\N)n1[c-]nc(C)c1C.C/[C-]=C/n1[c-]nc(C)c1C.[Y].[Y].[Y].[Y]
InChIInChI=1S/2C8H11N3.2C8H10N2.4Y/c1-4-8(9)11-5-10-6(2)7(11)3;1-4-6(2)11-5-10-7(3)8(11)9;1-4-8(3)10-5-7(2)9-6-10;1-4-5-10-6-9-7(2)8(10)3;;;;/h2*9H2,1-3H3;2*5H,1-3H3;;;;/q4*-2;;;;
InChIKeyQHGKZZLZKMRGPH-UHFFFAOYSA-N
XLogP5.40
TPSA123.32 Ų
H-Bond Donors2
H-Bond Acceptors10
Rotatable Bonds4
Heavy Atoms46
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500922.38
LogP ≤ 55.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

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

Analyze 3-but-2-en-2-yl-5-methyl-2H-imidazol-2-id-4-amine;1-but-2-en-2-yl-4-methyl-2H-imidazol-2-ide;1-(4,5-dimethyl-2H-imidazol-2-id-1-yl)prop-1-en-1-amine;4,5-dimethyl-1-prop-1-enyl-2H-imidazol-2-ide;tetrakis(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 3-but-2-en-2-yl-5-methyl-2H-imidazol-2-id-4-amine;1-but-2-en-2-yl-4-methyl-2H-imidazol-2-ide;1-(4,5-dimethyl-2H-imidazol-2-id-1-yl)prop-1-en-1-amine;4,5-dimethyl-1-prop-1-enyl-2H-imidazol-2-ide;tetrakis(yttrium)?
The IUPAC name of 3-but-2-en-2-yl-5-methyl-2H-imidazol-2-id-4-amine;1-but-2-en-2-yl-4-methyl-2H-imidazol-2-ide;1-(4,5-dimethyl-2H-imidazol-2-id-1-yl)prop-1-en-1-amine;4,5-dimethyl-1-prop-1-enyl-2H-imidazol-2-ide;tetrakis(yttrium) (CID 159646891) is 3-but-2-en-2-yl-5-methyl-2H-imidazol-2-id-4-amine;1-but-2-en-2-yl-4-methyl-2H-imidazol-2-ide;1-(4,5-dimethyl-2H-imidazol-2-id-1-yl)prop-1-en-1-amine;4,5-dimethyl-1-prop-1-enyl-2H-imidazol-2-ide;tetrakis(yttrium).
What is the SMILES notation for 3-but-2-en-2-yl-5-methyl-2H-imidazol-2-id-4-amine;1-but-2-en-2-yl-4-methyl-2H-imidazol-2-ide;1-(4,5-dimethyl-2H-imidazol-2-id-1-yl)prop-1-en-1-amine;4,5-dimethyl-1-prop-1-enyl-2H-imidazol-2-ide;tetrakis(yttrium)?
The canonical SMILES for 3-but-2-en-2-yl-5-methyl-2H-imidazol-2-id-4-amine;1-but-2-en-2-yl-4-methyl-2H-imidazol-2-ide;1-(4,5-dimethyl-2H-imidazol-2-id-1-yl)prop-1-en-1-amine;4,5-dimethyl-1-prop-1-enyl-2H-imidazol-2-ide;tetrakis(yttrium) is C/[C-]=C(\C)n1[c-]nc(C)c1.C/[C-]=C(\C)n1[c-]nc(C)c1N.C/[C-]=C(\N)n1[c-]nc(C)c1C.C/[C-]=C/n1[c-]nc(C)c1C.[Y].[Y].[Y].[Y].
What is the InChIKey of 3-but-2-en-2-yl-5-methyl-2H-imidazol-2-id-4-amine;1-but-2-en-2-yl-4-methyl-2H-imidazol-2-ide;1-(4,5-dimethyl-2H-imidazol-2-id-1-yl)prop-1-en-1-amine;4,5-dimethyl-1-prop-1-enyl-2H-imidazol-2-ide;tetrakis(yttrium)?
The InChIKey is QHGKZZLZKMRGPH-UHFFFAOYSA-N. The full InChI is InChI=1S/2C8H11N3.2C8H10N2.4Y/c1-4-8(9)11-5-10-6(2)7(11)3;1-4-6(2)11-5-10-7(3)8(11)9;1-4-8(3)10-5-7(2)9-6-10;1-4-5-10-6-9-7(2)8(10)3;;;;/h2*9H2,1-3H3;2*5H,1-3H3;;;;/q4*-2;;;;.
What are the key properties of 3-but-2-en-2-yl-5-methyl-2H-imidazol-2-id-4-amine;1-but-2-en-2-yl-4-methyl-2H-imidazol-2-ide;1-(4,5-dimethyl-2H-imidazol-2-id-1-yl)prop-1-en-1-amine;4,5-dimethyl-1-prop-1-enyl-2H-imidazol-2-ide;tetrakis(yttrium)?
3-but-2-en-2-yl-5-methyl-2H-imidazol-2-id-4-amine;1-but-2-en-2-yl-4-methyl-2H-imidazol-2-ide;1-(4,5-dimethyl-2H-imidazol-2-id-1-yl)prop-1-en-1-amine;4,5-dimethyl-1-prop-1-enyl-2H-imidazol-2-ide;tetrakis(yttrium) has a molecular weight of 922.38 g/mol, XLogP of 5.40, 4 rotatable bonds, 2 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 3-but-2-en-2-yl-5-methyl-2H-imidazol-2-id-4-amine;1-but-2-en-2-yl-4-methyl-2H-imidazol-2-ide;1-(4,5-dimethyl-2H-imidazol-2-id-1-yl)prop-1-en-1-amine;4,5-dimethyl-1-prop-1-enyl-2H-imidazol-2-ide;tetrakis(yttrium) is sourced from PubChem (CID 159646891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).