methyl(3-methylbut-2-enyl)azanide;yttrium(3+)

C6H12NY+2 — CID 20767491

IUPACmethyl(3-methylbut-2-enyl)azanide;yttrium(3+)
SMILESC[N-]CC=C(C)C.[Y+3]
InChIInChI=1S/C6H12N.Y/c1-6(2)4-5-7-3;/h4H,5H2,1-3H3;/q-1;+3
InChIKeyVSCHDPKBJPCEOP-UHFFFAOYSA-N
MW187.08 g/mol
LogP1.95
Rot. Bonds2

About methyl(3-methylbut-2-enyl)azanide;yttrium(3+)

methyl(3-methylbut-2-enyl)azanide;yttrium(3+) (PubChem CID 20767491) has the molecular formula C6H12NY+2 and a molecular weight of 187.08 g/mol. Its IUPAC name is methyl(3-methylbut-2-enyl)azanide;yttrium(3+).

Molecular Properties

Compound Namemethyl(3-methylbut-2-enyl)azanide;yttrium(3+)
PubChem CID20767491
Molecular FormulaC6H12NY+2
Molecular Weight187.08 g/mol
Exact Mass187.00
IUPAC Namemethyl(3-methylbut-2-enyl)azanide;yttrium(3+)
SMILESC[N-]CC=C(C)C.[Y+3]
InChIInChI=1S/C6H12N.Y/c1-6(2)4-5-7-3;/h4H,5H2,1-3H3;/q-1;+3
InChIKeyVSCHDPKBJPCEOP-UHFFFAOYSA-N
XLogP1.95
TPSA14.10 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.08
LogP ≤ 51.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(E)-3-methyl(411C)but-2-en-1-ol
CID 11693897
3-methylbut-2-en-1-ol;hydrate
CID 172859141
N,3-dimethylbut-2-en-1-amine
CID 12688299
2,8-dimethyl-5-(3-methylbut-2-enyl)nona-2,7-diene
CID 58242815
5-ethyl-2,5-dimethylhept-2-ene
CID 123530387
3-methylbut-2-enyltin(3+);tris(2-methylpropan-2-olate)
CID 174192053
(2E)-3,4,4,7-tetramethylocta-2,6-dienal
CID 12813408
methanolate;3-methylbut-2-enyltin(3+)
CID 174192020
trimethyl(3-methylbut-2-enyl)silane
CID 642563
N,3-dimethylbut-2-en-1-amine;hydrochloride
CID 155386233
trimethyl(3-methylbut-2-enyl)stannane
CID 12519739
(5E)-2,5-dimethylhepta-2,5-diene
CID 12688397

Frequently Asked Questions

What is the IUPAC name of methyl(3-methylbut-2-enyl)azanide;yttrium(3+)?
The IUPAC name of methyl(3-methylbut-2-enyl)azanide;yttrium(3+) (CID 20767491) is methyl(3-methylbut-2-enyl)azanide;yttrium(3+).
What is the SMILES notation for methyl(3-methylbut-2-enyl)azanide;yttrium(3+)?
The canonical SMILES for methyl(3-methylbut-2-enyl)azanide;yttrium(3+) is C[N-]CC=C(C)C.[Y+3].
What is the InChIKey of methyl(3-methylbut-2-enyl)azanide;yttrium(3+)?
The InChIKey is VSCHDPKBJPCEOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N.Y/c1-6(2)4-5-7-3;/h4H,5H2,1-3H3;/q-1;+3.
What are the key properties of methyl(3-methylbut-2-enyl)azanide;yttrium(3+)?
methyl(3-methylbut-2-enyl)azanide;yttrium(3+) has a molecular weight of 187.08 g/mol, XLogP of 1.95, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for methyl(3-methylbut-2-enyl)azanide;yttrium(3+) is sourced from PubChem (CID 20767491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).