methylidene-[3-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)propyl]-λ3-iodane

C10H24INSi2 — CID 163651267

IUPACmethylidene-[3-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)propyl]-λ3-iodane
SMILESC=ICCCN1[Si](C)(C)CC[Si]1(C)C
InChIInChI=1S/C10H24INSi2/c1-11-7-6-8-12-13(2,3)9-10-14(12,4)5/h1,6-10H2,2-5H3
InChIKeyIMLLRGUDNVKNJE-UHFFFAOYSA-N
MW341.39 g/mol
LogP3.51
Rot. Bonds4

About methylidene-[3-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)propyl]-λ3-iodane

methylidene-[3-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)propyl]-λ3-iodane (PubChem CID 163651267) has the molecular formula C10H24INSi2 and a molecular weight of 341.39 g/mol. Its IUPAC name is methylidene-[3-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)propyl]-λ3-iodane.

Molecular Properties

Compound Namemethylidene-[3-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)propyl]-λ3-iodane
PubChem CID163651267
Molecular FormulaC10H24INSi2
Molecular Weight341.39 g/mol
Exact Mass341.05
IUPAC Namemethylidene-[3-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)propyl]-λ3-iodane
SMILESC=ICCCN1[Si](C)(C)CC[Si]1(C)C
InChIInChI=1S/C10H24INSi2/c1-11-7-6-8-12-13(2,3)9-10-14(12,4)5/h1,6-10H2,2-5H3
InChIKeyIMLLRGUDNVKNJE-UHFFFAOYSA-N
XLogP3.51
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.39
LogP ≤ 53.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of methylidene-[3-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)propyl]-λ3-iodane?
The IUPAC name of methylidene-[3-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)propyl]-λ3-iodane (CID 163651267) is methylidene-[3-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)propyl]-λ3-iodane.
What is the SMILES notation for methylidene-[3-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)propyl]-λ3-iodane?
The canonical SMILES for methylidene-[3-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)propyl]-λ3-iodane is C=ICCCN1[Si](C)(C)CC[Si]1(C)C.
What is the InChIKey of methylidene-[3-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)propyl]-λ3-iodane?
The InChIKey is IMLLRGUDNVKNJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24INSi2/c1-11-7-6-8-12-13(2,3)9-10-14(12,4)5/h1,6-10H2,2-5H3.
What are the key properties of methylidene-[3-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)propyl]-λ3-iodane?
methylidene-[3-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)propyl]-λ3-iodane has a molecular weight of 341.39 g/mol, XLogP of 3.51, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methylidene-[3-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)propyl]-λ3-iodane is sourced from PubChem (CID 163651267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).