tetramethylazanium;titanium(4+)

C4H12NTi+5 — CID 159533487

IUPACtetramethylazanium;titanium(4+)
SMILESC[N+](C)(C)C.[Ti+4]
InChIInChI=1S/C4H12N.Ti/c1-5(2,3)4;/h1-4H3;/q+1;+4
InChIKeyMDHJNKFLHDPGRI-UHFFFAOYSA-N
MW122.01 g/mol
LogP0.32
Rot. Bonds

About tetramethylazanium;titanium(4+)

tetramethylazanium;titanium(4+) (PubChem CID 159533487) has the molecular formula C4H12NTi+5 and a molecular weight of 122.01 g/mol. Its IUPAC name is tetramethylazanium;titanium(4+).

Molecular Properties

Compound Nametetramethylazanium;titanium(4+)
PubChem CID159533487
Molecular FormulaC4H12NTi+5
Molecular Weight122.01 g/mol
Exact Mass122.04
IUPAC Nametetramethylazanium;titanium(4+)
SMILESC[N+](C)(C)C.[Ti+4]
InChIInChI=1S/C4H12N.Ti/c1-5(2,3)4;/h1-4H3;/q+1;+4
InChIKeyMDHJNKFLHDPGRI-UHFFFAOYSA-N
XLogP0.32
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.01
LogP ≤ 50.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

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Related Compounds

tetra((113C)methyl)azanium
CID 171381348
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lead(2+);tetramethylazanium
CID 88599157
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CID 173386862
lithium;tetramethylazanium;iodide
CID 23714779
sodium;tetramethylazanium;dichloride
CID 173400677
molecular iodine;tetramethylazanium
CID 157068254
sodium;tetramethylazanium;chloride
CID 23689798
phosphinous acid;tris(tetramethylazanium)
CID 173308937
methanol;tetramethylazanium;chloride
CID 18968276
sodium;hydride;tetramethylazanium;hydrochloride
CID 173460046
formaldehyde;tetramethylazanium
CID 57468222

Frequently Asked Questions

What is the IUPAC name of tetramethylazanium;titanium(4+)?
The IUPAC name of tetramethylazanium;titanium(4+) (CID 159533487) is tetramethylazanium;titanium(4+).
What is the SMILES notation for tetramethylazanium;titanium(4+)?
The canonical SMILES for tetramethylazanium;titanium(4+) is C[N+](C)(C)C.[Ti+4].
What is the InChIKey of tetramethylazanium;titanium(4+)?
The InChIKey is MDHJNKFLHDPGRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H12N.Ti/c1-5(2,3)4;/h1-4H3;/q+1;+4.
What are the key properties of tetramethylazanium;titanium(4+)?
tetramethylazanium;titanium(4+) has a molecular weight of 122.01 g/mol, XLogP of 0.32, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tetramethylazanium;titanium(4+) is sourced from PubChem (CID 159533487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).