dichlorotitanium;methyl(4-methylazanidylbutyl)azanide

C6H14Cl2N2Ti-2 — CID 22968057

IUPACdichlorotitanium;methyl(4-methylazanidylbutyl)azanide
SMILESC[N-]CCCC[N-]C.Cl[Ti]Cl
InChIInChI=1S/C6H14N2.2ClH.Ti/c1-7-5-3-4-6-8-2;;;/h3-6H2,1-2H3;2*1H;/q-2;;;+2/p-2
InChIKeySOCNBCMDQXYGRC-UHFFFAOYSA-L
MW232.96 g/mol
LogP3.15
Rot. Bonds5

About dichlorotitanium;methyl(4-methylazanidylbutyl)azanide

dichlorotitanium;methyl(4-methylazanidylbutyl)azanide (PubChem CID 22968057) has the molecular formula C6H14Cl2N2Ti-2 and a molecular weight of 232.96 g/mol. Its IUPAC name is dichlorotitanium;methyl(4-methylazanidylbutyl)azanide.

Molecular Properties

Compound Namedichlorotitanium;methyl(4-methylazanidylbutyl)azanide
PubChem CID22968057
Molecular FormulaC6H14Cl2N2Ti-2
Molecular Weight232.96 g/mol
Exact Mass232.00
IUPAC Namedichlorotitanium;methyl(4-methylazanidylbutyl)azanide
SMILESC[N-]CCCC[N-]C.Cl[Ti]Cl
InChIInChI=1S/C6H14N2.2ClH.Ti/c1-7-5-3-4-6-8-2;;;/h3-6H2,1-2H3;2*1H;/q-2;;;+2/p-2
InChIKeySOCNBCMDQXYGRC-UHFFFAOYSA-L
XLogP3.15
TPSA28.20 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.96
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

bis(methyl(3-methylazanidylpropyl)azanide);zinc
CID 168728787
decyl(methyl)azanide;ethane;nobelium
CID 156794767
5-methoxypentyl(methyl)azanide
CID 155624838
methyl(5-oxopentyl)azanide;vanadium
CID 168958729
bis(dibutylazanide);dichlorotitanium
CID 87309711
carbanide;dimethylazanide;methyl(2-methylazanidylethyl)azanide;zirconium(4+)
CID 171766717
dichlorotitanium;propane
CID 174420239
4-(4-hydroxyphenyl)butyl-methylazanide
CID 59713445
beryllium;2-(dimethylamino)ethyl-methylazanide;hydride
CID 134906139
copper bis(2-azanidylethyl(methyl)azanide)
CID 5257957
butyl-[methanidyl(dimethyl)silyl]azanide;dichlorotitanium
CID 59057451
ethyl(methyl)azanide;titanium(4+);trichloride
CID 174657881

Frequently Asked Questions

What is the IUPAC name of dichlorotitanium;methyl(4-methylazanidylbutyl)azanide?
The IUPAC name of dichlorotitanium;methyl(4-methylazanidylbutyl)azanide (CID 22968057) is dichlorotitanium;methyl(4-methylazanidylbutyl)azanide.
What is the SMILES notation for dichlorotitanium;methyl(4-methylazanidylbutyl)azanide?
The canonical SMILES for dichlorotitanium;methyl(4-methylazanidylbutyl)azanide is C[N-]CCCC[N-]C.Cl[Ti]Cl.
What is the InChIKey of dichlorotitanium;methyl(4-methylazanidylbutyl)azanide?
The InChIKey is SOCNBCMDQXYGRC-UHFFFAOYSA-L. The full InChI is InChI=1S/C6H14N2.2ClH.Ti/c1-7-5-3-4-6-8-2;;;/h3-6H2,1-2H3;2*1H;/q-2;;;+2/p-2.
What are the key properties of dichlorotitanium;methyl(4-methylazanidylbutyl)azanide?
dichlorotitanium;methyl(4-methylazanidylbutyl)azanide has a molecular weight of 232.96 g/mol, XLogP of 3.15, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dichlorotitanium;methyl(4-methylazanidylbutyl)azanide is sourced from PubChem (CID 22968057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).