tris(bis(trimethylsilyl)azanide);cyclopenta-1,3-diene;titanium(4+)

C23H59N3Si6Ti — CID 23102942

IUPACtris(bis(trimethylsilyl)azanide);cyclopenta-1,3-diene;titanium(4+)
SMILESC[Si](C)(C)[N-][Si](C)(C)C.C[Si](C)(C)[N-][Si](C)(C)C.C[Si](C)(C)[N-][Si](C)(C)C.[C-]1=CC=CC1.[Ti+4]
InChIInChI=1S/3C6H18NSi2.C5H5.Ti/c3*1-8(2,3)7-9(4,5)6;1-2-4-5-3-1;/h3*1-6H3;1-3H,4H2;/q4*-1;+4
InChIKeyUGKFVQDXAQAWSS-UHFFFAOYSA-N
MW594.13 g/mol
LogP10.39
Rot. Bonds6

About tris(bis(trimethylsilyl)azanide);cyclopenta-1,3-diene;titanium(4+)

tris(bis(trimethylsilyl)azanide);cyclopenta-1,3-diene;titanium(4+) (PubChem CID 23102942) has the molecular formula C23H59N3Si6Ti and a molecular weight of 594.13 g/mol. Its IUPAC name is tris(bis(trimethylsilyl)azanide);cyclopenta-1,3-diene;titanium(4+).

Molecular Properties

Compound Nametris(bis(trimethylsilyl)azanide);cyclopenta-1,3-diene;titanium(4+)
PubChem CID23102942
Molecular FormulaC23H59N3Si6Ti
Molecular Weight594.13 g/mol
Exact Mass593.28
IUPAC Nametris(bis(trimethylsilyl)azanide);cyclopenta-1,3-diene;titanium(4+)
SMILESC[Si](C)(C)[N-][Si](C)(C)C.C[Si](C)(C)[N-][Si](C)(C)C.C[Si](C)(C)[N-][Si](C)(C)C.[C-]1=CC=CC1.[Ti+4]
InChIInChI=1S/3C6H18NSi2.C5H5.Ti/c3*1-8(2,3)7-9(4,5)6;1-2-4-5-3-1;/h3*1-6H3;1-3H,4H2;/q4*-1;+4
InChIKeyUGKFVQDXAQAWSS-UHFFFAOYSA-N
XLogP10.39
TPSA42.30 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500594.13
LogP ≤ 510.39
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 tris(bis(trimethylsilyl)azanide);cyclopenta-1,3-diene;titanium(4+)?
The IUPAC name of tris(bis(trimethylsilyl)azanide);cyclopenta-1,3-diene;titanium(4+) (CID 23102942) is tris(bis(trimethylsilyl)azanide);cyclopenta-1,3-diene;titanium(4+).
What is the SMILES notation for tris(bis(trimethylsilyl)azanide);cyclopenta-1,3-diene;titanium(4+)?
The canonical SMILES for tris(bis(trimethylsilyl)azanide);cyclopenta-1,3-diene;titanium(4+) is C[Si](C)(C)[N-][Si](C)(C)C.C[Si](C)(C)[N-][Si](C)(C)C.C[Si](C)(C)[N-][Si](C)(C)C.[C-]1=CC=CC1.[Ti+4].
What is the InChIKey of tris(bis(trimethylsilyl)azanide);cyclopenta-1,3-diene;titanium(4+)?
The InChIKey is UGKFVQDXAQAWSS-UHFFFAOYSA-N. The full InChI is InChI=1S/3C6H18NSi2.C5H5.Ti/c3*1-8(2,3)7-9(4,5)6;1-2-4-5-3-1;/h3*1-6H3;1-3H,4H2;/q4*-1;+4.
What are the key properties of tris(bis(trimethylsilyl)azanide);cyclopenta-1,3-diene;titanium(4+)?
tris(bis(trimethylsilyl)azanide);cyclopenta-1,3-diene;titanium(4+) has a molecular weight of 594.13 g/mol, XLogP of 10.39, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tris(bis(trimethylsilyl)azanide);cyclopenta-1,3-diene;titanium(4+) is sourced from PubChem (CID 23102942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).