CID 172744424

FeLiMnNi — CID 172744424

IUPAC—
SMILES[Fe].[Li].[Mn].[Ni]
InChIInChI=1S/Fe.Li.Mn.Ni
InChIKeyJNKBOFWCTUSAAT-UHFFFAOYSA-N
MW176.42 g/mol
LogP-0.39
Rot. Bonds

About CID 172744424

CID 172744424 (PubChem CID 172744424) has the molecular formula FeLiMnNi and a molecular weight of 176.42 g/mol.

Molecular Properties

Compound NameCID 172744424
PubChem CID172744424
Molecular FormulaFeLiMnNi
Molecular Weight176.42 g/mol
Exact Mass175.82
IUPAC Name—
SMILES[Fe].[Li].[Mn].[Ni]
InChIInChI=1S/Fe.Li.Mn.Ni
InChIKeyJNKBOFWCTUSAAT-UHFFFAOYSA-N
XLogP-0.39
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.42
LogP ≤ 5-0.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze CID 172744424 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

iron;manganese;nickel;dihydrate
CID 175404150
CID 175754545
CID 175754545
CID 172738205
CID 172738205
CID 172768393
CID 172768393
iron;manganese;nickel;zinc;hydrate
CID 174387819
copper;iron;manganese;nickel;silane
CID 173225605
chromium;iron;manganese;nickel;tungsten
CID 173098645
magnesium;cobalt;hydride;iron;manganese;nickel
CID 173415795
CID 174801128
CID 174801128
CID 173289602
CID 173289602
CID 159288850
CID 159288850
iron;manganese;nickel;cyanide
CID 175608785

Frequently Asked Questions

What is the IUPAC name of CID 172744424?
The IUPAC name of CID 172744424 (CID 172744424) is not available.
What is the SMILES notation for CID 172744424?
The canonical SMILES for CID 172744424 is [Fe].[Li].[Mn].[Ni].
What is the InChIKey of CID 172744424?
The InChIKey is JNKBOFWCTUSAAT-UHFFFAOYSA-N. The full InChI is InChI=1S/Fe.Li.Mn.Ni.
What are the key properties of CID 172744424?
CID 172744424 has a molecular weight of 176.42 g/mol, XLogP of -0.39, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 172744424 is sourced from PubChem (CID 172744424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).