cyclohexylazanide;titanium(3+);dichloride

C6H12Cl2NTi — CID 174472859

IUPACcyclohexylazanide;titanium(3+);dichloride
SMILES[Cl-].[Cl-].[NH-]C1CCCCC1.[Ti+3]
InChIInChI=1S/C6H12N.2ClH.Ti/c7-6-4-2-1-3-5-6;;;/h6-7H,1-5H2;2*1H;/q-1;;;+3/p-2
InChIKeyMRXLZNFCGXBPMT-UHFFFAOYSA-L
MW216.94 g/mol
LogP-3.62
Rot. Bonds

About cyclohexylazanide;titanium(3+);dichloride

cyclohexylazanide;titanium(3+);dichloride (PubChem CID 174472859) has the molecular formula C6H12Cl2NTi and a molecular weight of 216.94 g/mol. Its IUPAC name is cyclohexylazanide;titanium(3+);dichloride.

Molecular Properties

Compound Namecyclohexylazanide;titanium(3+);dichloride
PubChem CID174472859
Molecular FormulaC6H12Cl2NTi
Molecular Weight216.94 g/mol
Exact Mass215.98
IUPAC Namecyclohexylazanide;titanium(3+);dichloride
SMILES[Cl-].[Cl-].[NH-]C1CCCCC1.[Ti+3]
InChIInChI=1S/C6H12N.2ClH.Ti/c7-6-4-2-1-3-5-6;;;/h6-7H,1-5H2;2*1H;/q-1;;;+3/p-2
InChIKeyMRXLZNFCGXBPMT-UHFFFAOYSA-L
XLogP-3.62
TPSA23.80 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.94
LogP ≤ 5-3.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of cyclohexylazanide;titanium(3+);dichloride?
The IUPAC name of cyclohexylazanide;titanium(3+);dichloride (CID 174472859) is cyclohexylazanide;titanium(3+);dichloride.
What is the SMILES notation for cyclohexylazanide;titanium(3+);dichloride?
The canonical SMILES for cyclohexylazanide;titanium(3+);dichloride is [Cl-].[Cl-].[NH-]C1CCCCC1.[Ti+3].
What is the InChIKey of cyclohexylazanide;titanium(3+);dichloride?
The InChIKey is MRXLZNFCGXBPMT-UHFFFAOYSA-L. The full InChI is InChI=1S/C6H12N.2ClH.Ti/c7-6-4-2-1-3-5-6;;;/h6-7H,1-5H2;2*1H;/q-1;;;+3/p-2.
What are the key properties of cyclohexylazanide;titanium(3+);dichloride?
cyclohexylazanide;titanium(3+);dichloride has a molecular weight of 216.94 g/mol, XLogP of -3.62, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexylazanide;titanium(3+);dichloride is sourced from PubChem (CID 174472859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).