carbanide;(2R)-2-methanidylhexane;yttrium;yttrium(3+)

C8H17Y2 — CID 171424303

IUPACcarbanide;(2R)-2-methanidylhexane;yttrium;yttrium(3+)
SMILES[CH2-]CCC[C@H]([CH2-])C.[CH3-].[Y+3].[Y]
InChIInChI=1S/C7H14.CH3.2Y/c1-4-5-6-7(2)3;;;/h7H,1-2,4-6H2,3H3;1H3;;/q-2;-1;;+3/t7-;;;/m1.../s1
InChIKeyAHALSCCSENWKJS-LSBIWMFESA-N
MW291.04 g/mol
LogP2.91
Rot. Bonds3

About carbanide;(2R)-2-methanidylhexane;yttrium;yttrium(3+)

carbanide;(2R)-2-methanidylhexane;yttrium;yttrium(3+) (PubChem CID 171424303) has the molecular formula C8H17Y2 and a molecular weight of 291.04 g/mol. Its IUPAC name is carbanide;(2R)-2-methanidylhexane;yttrium;yttrium(3+).

Molecular Properties

Compound Namecarbanide;(2R)-2-methanidylhexane;yttrium;yttrium(3+)
PubChem CID171424303
Molecular FormulaC8H17Y2
Molecular Weight291.04 g/mol
Exact Mass290.94
IUPAC Namecarbanide;(2R)-2-methanidylhexane;yttrium;yttrium(3+)
SMILES[CH2-]CCC[C@H]([CH2-])C.[CH3-].[Y+3].[Y]
InChIInChI=1S/C7H14.CH3.2Y/c1-4-5-6-7(2)3;;;/h7H,1-2,4-6H2,3H3;1H3;;/q-2;-1;;+3/t7-;;;/m1.../s1
InChIKeyAHALSCCSENWKJS-LSBIWMFESA-N
XLogP2.91
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.04
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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CID 171424214
tetrakis(2-methylhexane);titanium(4+)
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carbanide;3,5,7-trimethylundecane;yttrium
CID 58340673
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CID 168763498
cobalt;2-methylheptane
CID 170567086
carbanide;gadolinium(2+);pentane
CID 174464461
carbanide;2-methanidylpropane;bis(yttrium)
CID 161365817
tris(2-methylheptadecane);titanium(3+)
CID 23174974
ethane;methane;pentane;yttrium
CID 158235395
magnesium;2-methylheptane;propane
CID 140617225
2-methylnonane;titanium;hydrate
CID 174186153
2-methyloctane;titanium(4+);trihydroxide
CID 174186181

Frequently Asked Questions

What is the IUPAC name of carbanide;(2R)-2-methanidylhexane;yttrium;yttrium(3+)?
The IUPAC name of carbanide;(2R)-2-methanidylhexane;yttrium;yttrium(3+) (CID 171424303) is carbanide;(2R)-2-methanidylhexane;yttrium;yttrium(3+).
What is the SMILES notation for carbanide;(2R)-2-methanidylhexane;yttrium;yttrium(3+)?
The canonical SMILES for carbanide;(2R)-2-methanidylhexane;yttrium;yttrium(3+) is [CH2-]CCC[C@H]([CH2-])C.[CH3-].[Y+3].[Y].
What is the InChIKey of carbanide;(2R)-2-methanidylhexane;yttrium;yttrium(3+)?
The InChIKey is AHALSCCSENWKJS-LSBIWMFESA-N. The full InChI is InChI=1S/C7H14.CH3.2Y/c1-4-5-6-7(2)3;;;/h7H,1-2,4-6H2,3H3;1H3;;/q-2;-1;;+3/t7-;;;/m1.../s1.
What are the key properties of carbanide;(2R)-2-methanidylhexane;yttrium;yttrium(3+)?
carbanide;(2R)-2-methanidylhexane;yttrium;yttrium(3+) has a molecular weight of 291.04 g/mol, XLogP of 2.91, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;(2R)-2-methanidylhexane;yttrium;yttrium(3+) is sourced from PubChem (CID 171424303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).