lithium;azane;bromide;hydrate

H5BrLiNO — CID 172848121

IUPAClithium;azane;bromide;hydrate
SMILESN.O.[Br-].[Li+]
InChIInChI=1S/BrH.Li.H3N.H2O/h1H;;1H3;1H2/q;+1;;/p-1
InChIKeyXRXUOBBPGPTIBH-UHFFFAOYSA-M
MW121.89 g/mol
LogP-6.65
Rot. Bonds

About lithium;azane;bromide;hydrate

lithium;azane;bromide;hydrate (PubChem CID 172848121) has the molecular formula H5BrLiNO and a molecular weight of 121.89 g/mol. Its IUPAC name is lithium;azane;bromide;hydrate.

Molecular Properties

Compound Namelithium;azane;bromide;hydrate
PubChem CID172848121
Molecular FormulaH5BrLiNO
Molecular Weight121.89 g/mol
Exact Mass120.97
IUPAC Namelithium;azane;bromide;hydrate
SMILESN.O.[Br-].[Li+]
InChIInChI=1S/BrH.Li.H3N.H2O/h1H;;1H3;1H2/q;+1;;/p-1
InChIKeyXRXUOBBPGPTIBH-UHFFFAOYSA-M
XLogP-6.65
TPSA66.50 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms4
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500121.89
LogP ≤ 5-6.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of lithium;azane;bromide;hydrate?
The IUPAC name of lithium;azane;bromide;hydrate (CID 172848121) is lithium;azane;bromide;hydrate.
What is the SMILES notation for lithium;azane;bromide;hydrate?
The canonical SMILES for lithium;azane;bromide;hydrate is N.O.[Br-].[Li+].
What is the InChIKey of lithium;azane;bromide;hydrate?
The InChIKey is XRXUOBBPGPTIBH-UHFFFAOYSA-M. The full InChI is InChI=1S/BrH.Li.H3N.H2O/h1H;;1H3;1H2/q;+1;;/p-1.
What are the key properties of lithium;azane;bromide;hydrate?
lithium;azane;bromide;hydrate has a molecular weight of 121.89 g/mol, XLogP of -6.65, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;azane;bromide;hydrate is sourced from PubChem (CID 172848121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).