niobium(5+);oxygen(2-);titanium(4+);nitrite

NNbO3Ti+6 — CID 160686988

IUPACniobium(5+);oxygen(2-);titanium(4+);nitrite
SMILESO=N[O-].[Nb+5].[O-2].[Ti+4]
InChIInChI=1S/HNO2.Nb.O.Ti/c2-1-3;;;/h(H,2,3);;;/q;+5;-2;+4/p-1
InChIKeyROWYLXNUCXWOPY-UHFFFAOYSA-M
MW202.78 g/mol
LogP0.13
Rot. Bonds

About niobium(5+);oxygen(2-);titanium(4+);nitrite

niobium(5+);oxygen(2-);titanium(4+);nitrite (PubChem CID 160686988) has the molecular formula NNbO3Ti+6 and a molecular weight of 202.78 g/mol. Its IUPAC name is niobium(5+);oxygen(2-);titanium(4+);nitrite.

Molecular Properties

Compound Nameniobium(5+);oxygen(2-);titanium(4+);nitrite
PubChem CID160686988
Molecular FormulaNNbO3Ti+6
Molecular Weight202.78 g/mol
Exact Mass202.84
IUPAC Nameniobium(5+);oxygen(2-);titanium(4+);nitrite
SMILESO=N[O-].[Nb+5].[O-2].[Ti+4]
InChIInChI=1S/HNO2.Nb.O.Ti/c2-1-3;;;/h(H,2,3);;;/q;+5;-2;+4/p-1
InChIKeyROWYLXNUCXWOPY-UHFFFAOYSA-M
XLogP0.13
TPSA80.99 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.78
LogP ≤ 50.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N_oxide', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze niobium(5+);oxygen(2-);titanium(4+);nitrite 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

aluminum;titanium(4+);heptanitrite
CID 22061867
CID 19007947
CID 19007947
nickel(2+) dinitrite
CID 20831815
Sodium nitrite N-15
CID 23662135
neodymium(3+) trinitrite
CID 158721016
lithium nitrite
CID 23673709
CID 20981982
CID 20981982
thorium nitrite
CID 154069841
lead(2+) nitrite
CID 23623754
silver nitrite
CID 25199704
praseodymium(3+) trinitrite
CID 161020304
platinum(2+) dinitrite
CID 173066293

Frequently Asked Questions

What is the IUPAC name of niobium(5+);oxygen(2-);titanium(4+);nitrite?
The IUPAC name of niobium(5+);oxygen(2-);titanium(4+);nitrite (CID 160686988) is niobium(5+);oxygen(2-);titanium(4+);nitrite.
What is the SMILES notation for niobium(5+);oxygen(2-);titanium(4+);nitrite?
The canonical SMILES for niobium(5+);oxygen(2-);titanium(4+);nitrite is O=N[O-].[Nb+5].[O-2].[Ti+4].
What is the InChIKey of niobium(5+);oxygen(2-);titanium(4+);nitrite?
The InChIKey is ROWYLXNUCXWOPY-UHFFFAOYSA-M. The full InChI is InChI=1S/HNO2.Nb.O.Ti/c2-1-3;;;/h(H,2,3);;;/q;+5;-2;+4/p-1.
What are the key properties of niobium(5+);oxygen(2-);titanium(4+);nitrite?
niobium(5+);oxygen(2-);titanium(4+);nitrite has a molecular weight of 202.78 g/mol, XLogP of 0.13, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for niobium(5+);oxygen(2-);titanium(4+);nitrite is sourced from PubChem (CID 160686988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).