azane;hydrate;hydrobromide

H6BrNO — CID 141372316

IUPACazane;hydrate;hydrobromide
SMILESBr.N.O
InChIInChI=1S/BrH.H3N.H2O/h1H;1H3;1H2
InChIKeyILQYTFGVIMVOTG-UHFFFAOYSA-N
MW115.96 g/mol
LogP-0.08
Rot. Bonds

About azane;hydrate;hydrobromide

azane;hydrate;hydrobromide (PubChem CID 141372316) has the molecular formula H6BrNO and a molecular weight of 115.96 g/mol. Its IUPAC name is azane;hydrate;hydrobromide.

Molecular Properties

Compound Nameazane;hydrate;hydrobromide
PubChem CID141372316
Molecular FormulaH6BrNO
Molecular Weight115.96 g/mol
Exact Mass114.96
IUPAC Nameazane;hydrate;hydrobromide
SMILESBr.N.O
InChIInChI=1S/BrH.H3N.H2O/h1H;1H3;1H2
InChIKeyILQYTFGVIMVOTG-UHFFFAOYSA-N
XLogP-0.08
TPSA66.50 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms3
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.96
LogP ≤ 5-0.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze azane;hydrate;hydrobromide 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

azane;dihydrate;hydrobromide
CID 174896993
azane;octadecahydrate
CID 174841699
azane;tetrahydrate
CID 172794729
azane;hydrate
CID 71309179
azane;pentahydrate
CID 173288415
decahydrate;tetrahydrobromide
CID 172713941
sodium;azane;hydrate
CID 173185966
azane;cobalt(3+);dihydrate
CID 15804321
azane;hafnium;hydrate
CID 172801077
azane;methane;trihydrobromide
CID 174458600
argon;azane;dihydrate
CID 172687174
azane;molybdenum;tetrahydrate
CID 172800914

Frequently Asked Questions

What is the IUPAC name of azane;hydrate;hydrobromide?
The IUPAC name of azane;hydrate;hydrobromide (CID 141372316) is azane;hydrate;hydrobromide.
What is the SMILES notation for azane;hydrate;hydrobromide?
The canonical SMILES for azane;hydrate;hydrobromide is Br.N.O.
What is the InChIKey of azane;hydrate;hydrobromide?
The InChIKey is ILQYTFGVIMVOTG-UHFFFAOYSA-N. The full InChI is InChI=1S/BrH.H3N.H2O/h1H;1H3;1H2.
What are the key properties of azane;hydrate;hydrobromide?
azane;hydrate;hydrobromide has a molecular weight of 115.96 g/mol, XLogP of -0.08, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for azane;hydrate;hydrobromide is sourced from PubChem (CID 141372316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).