iron(3+);piperidin-1-ide

C5H10FeN+2 — CID 150983339

IUPACiron(3+);piperidin-1-ide
SMILESC1CC[N-]CC1.[Fe+3]
InChIInChI=1S/C5H10N.Fe/c1-2-4-6-5-3-1;/h1-5H2;/q-1;+3
InChIKeyLQOFQSWCEMAFHJ-UHFFFAOYSA-N
MW139.99 g/mol
LogP1.54
Rot. Bonds

About iron(3+);piperidin-1-ide

iron(3+);piperidin-1-ide (PubChem CID 150983339) has the molecular formula C5H10FeN+2 and a molecular weight of 139.99 g/mol. Its IUPAC name is iron(3+);piperidin-1-ide.

Molecular Properties

Compound Nameiron(3+);piperidin-1-ide
PubChem CID150983339
Molecular FormulaC5H10FeN+2
Molecular Weight139.99 g/mol
Exact Mass140.02
IUPAC Nameiron(3+);piperidin-1-ide
SMILESC1CC[N-]CC1.[Fe+3]
InChIInChI=1S/C5H10N.Fe/c1-2-4-6-5-3-1;/h1-5H2;/q-1;+3
InChIKeyLQOFQSWCEMAFHJ-UHFFFAOYSA-N
XLogP1.54
TPSA14.10 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.99
LogP ≤ 51.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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CID 151025303
azanidacycloheptane;tungsten
CID 156681038
carbanide;piperidin-1-ide;titanium(3+)
CID 20687678
bis(piperidin-1-ide);trichlororhodium
CID 54604493
difluorozirconium(2+);bis(piperidin-1-ide)
CID 173243334
nickel(2+);1,4,8,11-tetrazanidacyclopentadecane
CID 50896977
cobalt;bis(piperidin-1-ide);diisothiocyanate
CID 54610742
carbon monoxide;chromium(6+);pyrrolidin-1-ide
CID 4210612
zinc;tetrakis(piperidin-1-ide);thiocyanic acid
CID 54605103
silver;3,6-dihydro-2H-pyridin-1-ide;piperidin-1-ide
CID 5234611

Frequently Asked Questions

What is the IUPAC name of iron(3+);piperidin-1-ide?
The IUPAC name of iron(3+);piperidin-1-ide (CID 150983339) is iron(3+);piperidin-1-ide.
What is the SMILES notation for iron(3+);piperidin-1-ide?
The canonical SMILES for iron(3+);piperidin-1-ide is C1CC[N-]CC1.[Fe+3].
What is the InChIKey of iron(3+);piperidin-1-ide?
The InChIKey is LQOFQSWCEMAFHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N.Fe/c1-2-4-6-5-3-1;/h1-5H2;/q-1;+3.
What are the key properties of iron(3+);piperidin-1-ide?
iron(3+);piperidin-1-ide has a molecular weight of 139.99 g/mol, XLogP of 1.54, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for iron(3+);piperidin-1-ide is sourced from PubChem (CID 150983339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).