diazanium;bis(2-hydroxypropanoate);titanium(2+);dihydroxide

C6H20N2O8Ti — CID 173141104

IUPACdiazanium;bis(2-hydroxypropanoate);titanium(2+);dihydroxide
SMILESCC(O)C(=O)[O-].CC(O)C(=O)[O-].[NH4+].[NH4+].[OH-].[OH-].[Ti+2]
InChIInChI=1S/2C3H6O3.2H3N.2H2O.Ti/c2*1-2(4)3(5)6;;;;;/h2*2,4H,1H3,(H,5,6);2*1H3;2*1H2;/q;;;;;;+2/p-2
InChIKeyIFTLYVOSXXNBGD-UHFFFAOYSA-L
MW296.10 g/mol
LogP-3.37
Rot. Bonds2

About diazanium;bis(2-hydroxypropanoate);titanium(2+);dihydroxide

diazanium;bis(2-hydroxypropanoate);titanium(2+);dihydroxide (PubChem CID 173141104) has the molecular formula C6H20N2O8Ti and a molecular weight of 296.10 g/mol. Its IUPAC name is diazanium;bis(2-hydroxypropanoate);titanium(2+);dihydroxide.

Molecular Properties

Compound Namediazanium;bis(2-hydroxypropanoate);titanium(2+);dihydroxide
PubChem CID173141104
Molecular FormulaC6H20N2O8Ti
Molecular Weight296.10 g/mol
Exact Mass296.07
IUPAC Namediazanium;bis(2-hydroxypropanoate);titanium(2+);dihydroxide
SMILESCC(O)C(=O)[O-].CC(O)C(=O)[O-].[NH4+].[NH4+].[OH-].[OH-].[Ti+2]
InChIInChI=1S/2C3H6O3.2H3N.2H2O.Ti/c2*1-2(4)3(5)6;;;;;/h2*2,4H,1H3,(H,5,6);2*1H3;2*1H2;/q;;;;;;+2/p-2
InChIKeyIFTLYVOSXXNBGD-UHFFFAOYSA-L
XLogP-3.37
TPSA253.72 Ų
H-Bond Donors4
H-Bond Acceptors8
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.10
LogP ≤ 5-3.37
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 108

Analyze diazanium;bis(2-hydroxypropanoate);titanium(2+);dihydroxide with MolForge

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

Launch Full Analysis

Related Compounds

bis(2-hydroxypropanoate);nickel(2+)
CID 15920056
azanium;tris(2-hydroxypropanoate);manganese(2+)
CID 158994016
silver (2R)-2-hydroxypropanoate
CID 14178856
potassium 2-hydroxypropanoate
CID 23671663
iodanium 2-hydroxypropanoate
CID 158316585
copper bis(2-hydroxypropanoate)
CID 13145
aluminum tris((2R)-2-hydroxypropanoate)
CID 175713416
tris(2-hydroxypropanoate);zirconium(3+)
CID 3048680
2-hydroxypropanoate;tantalum(5+)
CID 172796362
strontium bis(2-hydroxypropanoate)
CID 91886528
gold(3+);tris(2-hydroxypropanoate)
CID 157164422
tris(2-hydroxypropanoate);yttrium(3+)
CID 14619044

Frequently Asked Questions

What is the IUPAC name of diazanium;bis(2-hydroxypropanoate);titanium(2+);dihydroxide?
The IUPAC name of diazanium;bis(2-hydroxypropanoate);titanium(2+);dihydroxide (CID 173141104) is diazanium;bis(2-hydroxypropanoate);titanium(2+);dihydroxide.
What is the SMILES notation for diazanium;bis(2-hydroxypropanoate);titanium(2+);dihydroxide?
The canonical SMILES for diazanium;bis(2-hydroxypropanoate);titanium(2+);dihydroxide is CC(O)C(=O)[O-].CC(O)C(=O)[O-].[NH4+].[NH4+].[OH-].[OH-].[Ti+2].
What is the InChIKey of diazanium;bis(2-hydroxypropanoate);titanium(2+);dihydroxide?
The InChIKey is IFTLYVOSXXNBGD-UHFFFAOYSA-L. The full InChI is InChI=1S/2C3H6O3.2H3N.2H2O.Ti/c2*1-2(4)3(5)6;;;;;/h2*2,4H,1H3,(H,5,6);2*1H3;2*1H2;/q;;;;;;+2/p-2.
What are the key properties of diazanium;bis(2-hydroxypropanoate);titanium(2+);dihydroxide?
diazanium;bis(2-hydroxypropanoate);titanium(2+);dihydroxide has a molecular weight of 296.10 g/mol, XLogP of -3.37, 2 rotatable bonds, 4 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for diazanium;bis(2-hydroxypropanoate);titanium(2+);dihydroxide is sourced from PubChem (CID 173141104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).