2-(4,4,4-trifluorobutyl)-1,3-diazanida-2-silacyclopentane;bis(yttrium)

C6H11F3N2SiY2-2 — CID 58632353

IUPAC2-(4,4,4-trifluorobutyl)-1,3-diazanida-2-silacyclopentane;bis(yttrium)
SMILESFC(F)(F)CCC[SiH]1[N-]CC[N-]1.[Y].[Y]
InChIInChI=1S/C6H11F3N2Si.2Y/c7-6(8,9)2-1-5-12-10-3-4-11-12;;/h12H,1-5H2;;/q-2;;
InChIKeyGLIGXPYAAVSFNO-UHFFFAOYSA-N
MW374.06 g/mol
LogP2.31
Rot. Bonds3

About 2-(4,4,4-trifluorobutyl)-1,3-diazanida-2-silacyclopentane;bis(yttrium)

2-(4,4,4-trifluorobutyl)-1,3-diazanida-2-silacyclopentane;bis(yttrium) (PubChem CID 58632353) has the molecular formula C6H11F3N2SiY2-2 and a molecular weight of 374.06 g/mol. Its IUPAC name is 2-(4,4,4-trifluorobutyl)-1,3-diazanida-2-silacyclopentane;bis(yttrium).

Molecular Properties

Compound Name2-(4,4,4-trifluorobutyl)-1,3-diazanida-2-silacyclopentane;bis(yttrium)
PubChem CID58632353
Molecular FormulaC6H11F3N2SiY2-2
Molecular Weight374.06 g/mol
Exact Mass373.88
IUPAC Name2-(4,4,4-trifluorobutyl)-1,3-diazanida-2-silacyclopentane;bis(yttrium)
SMILESFC(F)(F)CCC[SiH]1[N-]CC[N-]1.[Y].[Y]
InChIInChI=1S/C6H11F3N2Si.2Y/c7-6(8,9)2-1-5-12-10-3-4-11-12;;/h12H,1-5H2;;/q-2;;
InChIKeyGLIGXPYAAVSFNO-UHFFFAOYSA-N
XLogP2.31
TPSA28.20 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.06
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(4,4,4-trifluorobutyl)-1,3-diazanida-2-silacyclopentane;bis(yttrium)?
The IUPAC name of 2-(4,4,4-trifluorobutyl)-1,3-diazanida-2-silacyclopentane;bis(yttrium) (CID 58632353) is 2-(4,4,4-trifluorobutyl)-1,3-diazanida-2-silacyclopentane;bis(yttrium).
What is the SMILES notation for 2-(4,4,4-trifluorobutyl)-1,3-diazanida-2-silacyclopentane;bis(yttrium)?
The canonical SMILES for 2-(4,4,4-trifluorobutyl)-1,3-diazanida-2-silacyclopentane;bis(yttrium) is FC(F)(F)CCC[SiH]1[N-]CC[N-]1.[Y].[Y].
What is the InChIKey of 2-(4,4,4-trifluorobutyl)-1,3-diazanida-2-silacyclopentane;bis(yttrium)?
The InChIKey is GLIGXPYAAVSFNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11F3N2Si.2Y/c7-6(8,9)2-1-5-12-10-3-4-11-12;;/h12H,1-5H2;;/q-2;;.
What are the key properties of 2-(4,4,4-trifluorobutyl)-1,3-diazanida-2-silacyclopentane;bis(yttrium)?
2-(4,4,4-trifluorobutyl)-1,3-diazanida-2-silacyclopentane;bis(yttrium) has a molecular weight of 374.06 g/mol, XLogP of 2.31, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,4,4-trifluorobutyl)-1,3-diazanida-2-silacyclopentane;bis(yttrium) is sourced from PubChem (CID 58632353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).