di(propan-2-yl)azanide;titanium(3+);dichloride

C6H14Cl2NTi — CID 160772025

IUPACdi(propan-2-yl)azanide;titanium(3+);dichloride
SMILESCC(C)[N-]C(C)C.[Cl-].[Cl-].[Ti+3]
InChIInChI=1S/C6H14N.2ClH.Ti/c1-5(2)7-6(3)4;;;/h5-6H,1-4H3;2*1H;/q-1;;;+3/p-2
InChIKeyRZLDWINFVXIBMT-UHFFFAOYSA-L
MW218.96 g/mol
LogP-3.82
Rot. Bonds2

About di(propan-2-yl)azanide;titanium(3+);dichloride

di(propan-2-yl)azanide;titanium(3+);dichloride (PubChem CID 160772025) has the molecular formula C6H14Cl2NTi and a molecular weight of 218.96 g/mol. Its IUPAC name is di(propan-2-yl)azanide;titanium(3+);dichloride.

Molecular Properties

Compound Namedi(propan-2-yl)azanide;titanium(3+);dichloride
PubChem CID160772025
Molecular FormulaC6H14Cl2NTi
Molecular Weight218.96 g/mol
Exact Mass218.00
IUPAC Namedi(propan-2-yl)azanide;titanium(3+);dichloride
SMILESCC(C)[N-]C(C)C.[Cl-].[Cl-].[Ti+3]
InChIInChI=1S/C6H14N.2ClH.Ti/c1-5(2)7-6(3)4;;;/h5-6H,1-4H3;2*1H;/q-1;;;+3/p-2
InChIKeyRZLDWINFVXIBMT-UHFFFAOYSA-L
XLogP-3.82
TPSA14.10 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.96
LogP ≤ 5-3.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze di(propan-2-yl)azanide;titanium(3+);dichloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of di(propan-2-yl)azanide;titanium(3+);dichloride?
The IUPAC name of di(propan-2-yl)azanide;titanium(3+);dichloride (CID 160772025) is di(propan-2-yl)azanide;titanium(3+);dichloride.
What is the SMILES notation for di(propan-2-yl)azanide;titanium(3+);dichloride?
The canonical SMILES for di(propan-2-yl)azanide;titanium(3+);dichloride is CC(C)[N-]C(C)C.[Cl-].[Cl-].[Ti+3].
What is the InChIKey of di(propan-2-yl)azanide;titanium(3+);dichloride?
The InChIKey is RZLDWINFVXIBMT-UHFFFAOYSA-L. The full InChI is InChI=1S/C6H14N.2ClH.Ti/c1-5(2)7-6(3)4;;;/h5-6H,1-4H3;2*1H;/q-1;;;+3/p-2.
What are the key properties of di(propan-2-yl)azanide;titanium(3+);dichloride?
di(propan-2-yl)azanide;titanium(3+);dichloride has a molecular weight of 218.96 g/mol, XLogP of -3.82, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for di(propan-2-yl)azanide;titanium(3+);dichloride is sourced from PubChem (CID 160772025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).