tert-butylazanide;methanidylidenesilane;propane;1,2,3,5-tetramethylcyclopenta-1,3-diene;titanium(4+)

C17H33NSiTi — CID 151637468

IUPACtert-butylazanide;methanidylidenesilane;propane;1,2,3,5-tetramethylcyclopenta-1,3-diene;titanium(4+)
SMILESCC(C)(C)[NH-].C[CH-]C.Cc1c[c-](C)c(C)c1C.[H][C-]=[SiH2].[Ti+4]
InChIInChI=1S/C9H13.C4H10N.C3H7.CH3Si.Ti/c1-6-5-7(2)9(4)8(6)3;1-4(2,3)5;1-3-2;1-2;/h5H,1-4H3;5H,1-3H3;3H,1-2H3;1H,2H2;/q4*-1;+4
InChIKeyQRUTWWVCESLFNR-UHFFFAOYSA-N
MW327.41 g/mol
LogP4.63
Rot. Bonds

About tert-butylazanide;methanidylidenesilane;propane;1,2,3,5-tetramethylcyclopenta-1,3-diene;titanium(4+)

tert-butylazanide;methanidylidenesilane;propane;1,2,3,5-tetramethylcyclopenta-1,3-diene;titanium(4+) (PubChem CID 151637468) has the molecular formula C17H33NSiTi and a molecular weight of 327.41 g/mol. Its IUPAC name is tert-butylazanide;methanidylidenesilane;propane;1,2,3,5-tetramethylcyclopenta-1,3-diene;titanium(4+).

Molecular Properties

Compound Nametert-butylazanide;methanidylidenesilane;propane;1,2,3,5-tetramethylcyclopenta-1,3-diene;titanium(4+)
PubChem CID151637468
Molecular FormulaC17H33NSiTi
Molecular Weight327.41 g/mol
Exact Mass327.19
IUPAC Nametert-butylazanide;methanidylidenesilane;propane;1,2,3,5-tetramethylcyclopenta-1,3-diene;titanium(4+)
SMILESCC(C)(C)[NH-].C[CH-]C.Cc1c[c-](C)c(C)c1C.[H][C-]=[SiH2].[Ti+4]
InChIInChI=1S/C9H13.C4H10N.C3H7.CH3Si.Ti/c1-6-5-7(2)9(4)8(6)3;1-4(2,3)5;1-3-2;1-2;/h5H,1-4H3;5H,1-3H3;3H,1-2H3;1H,2H2;/q4*-1;+4
InChIKeyQRUTWWVCESLFNR-UHFFFAOYSA-N
XLogP4.63
TPSA23.80 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.41
LogP ≤ 54.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of tert-butylazanide;methanidylidenesilane;propane;1,2,3,5-tetramethylcyclopenta-1,3-diene;titanium(4+)?
The IUPAC name of tert-butylazanide;methanidylidenesilane;propane;1,2,3,5-tetramethylcyclopenta-1,3-diene;titanium(4+) (CID 151637468) is tert-butylazanide;methanidylidenesilane;propane;1,2,3,5-tetramethylcyclopenta-1,3-diene;titanium(4+).
What is the SMILES notation for tert-butylazanide;methanidylidenesilane;propane;1,2,3,5-tetramethylcyclopenta-1,3-diene;titanium(4+)?
The canonical SMILES for tert-butylazanide;methanidylidenesilane;propane;1,2,3,5-tetramethylcyclopenta-1,3-diene;titanium(4+) is CC(C)(C)[NH-].C[CH-]C.Cc1c[c-](C)c(C)c1C.[H][C-]=[SiH2].[Ti+4].
What is the InChIKey of tert-butylazanide;methanidylidenesilane;propane;1,2,3,5-tetramethylcyclopenta-1,3-diene;titanium(4+)?
The InChIKey is QRUTWWVCESLFNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13.C4H10N.C3H7.CH3Si.Ti/c1-6-5-7(2)9(4)8(6)3;1-4(2,3)5;1-3-2;1-2;/h5H,1-4H3;5H,1-3H3;3H,1-2H3;1H,2H2;/q4*-1;+4.
What are the key properties of tert-butylazanide;methanidylidenesilane;propane;1,2,3,5-tetramethylcyclopenta-1,3-diene;titanium(4+)?
tert-butylazanide;methanidylidenesilane;propane;1,2,3,5-tetramethylcyclopenta-1,3-diene;titanium(4+) has a molecular weight of 327.41 g/mol, XLogP of 4.63, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butylazanide;methanidylidenesilane;propane;1,2,3,5-tetramethylcyclopenta-1,3-diene;titanium(4+) is sourced from PubChem (CID 151637468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).