carbanide;bis(cyclopentane);iron(2+)

C12H26Fe — CID 162297433

IUPACcarbanide;bis(cyclopentane);iron(2+)
SMILESC1CCCC1.C1CCCC1.[CH3-].[CH3-].[Fe+2]
InChIInChI=1S/2C5H10.2CH3.Fe/c2*1-2-4-5-3-1;;;/h2*1-5H2;2*1H3;/q;;2*-1;+2
InChIKeyGTAAFKAMYXFIMN-UHFFFAOYSA-N
MW226.18 g/mol
LogP4.80
Rot. Bonds

About carbanide;bis(cyclopentane);iron(2+)

carbanide;bis(cyclopentane);iron(2+) (PubChem CID 162297433) has the molecular formula C12H26Fe and a molecular weight of 226.18 g/mol. Its IUPAC name is carbanide;bis(cyclopentane);iron(2+).

Molecular Properties

Compound Namecarbanide;bis(cyclopentane);iron(2+)
PubChem CID162297433
Molecular FormulaC12H26Fe
Molecular Weight226.18 g/mol
Exact Mass226.14
IUPAC Namecarbanide;bis(cyclopentane);iron(2+)
SMILESC1CCCC1.C1CCCC1.[CH3-].[CH3-].[Fe+2]
InChIInChI=1S/2C5H10.2CH3.Fe/c2*1-2-4-5-3-1;;;/h2*1-5H2;2*1H3;/q;;2*-1;+2
InChIKeyGTAAFKAMYXFIMN-UHFFFAOYSA-N
XLogP4.80
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.18
LogP ≤ 54.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

bis(cyclopentane);iron(2+)
CID 162302479
carbanide;cyclobutane;bis(cyclopentane);uranium
CID 159029541
cyclooctacosane
CID 520451
cyclobutane;cycloheptane;cyclohexane;cyclooctane;cyclopentane
CID 159212715
cyclooctane
CID 9266
cyclobutane;cyclopropane
CID 159057906
cyclopentane
CID 141332554
cycloheptane;cyclopropane
CID 165090184
cycloheptane;silane
CID 158344196
magnesium cyclohexane
CID 23347282
bis(cyclopentane);hydrate
CID 19957864
cyclobutane;methane
CID 159348077

Frequently Asked Questions

What is the IUPAC name of carbanide;bis(cyclopentane);iron(2+)?
The IUPAC name of carbanide;bis(cyclopentane);iron(2+) (CID 162297433) is carbanide;bis(cyclopentane);iron(2+).
What is the SMILES notation for carbanide;bis(cyclopentane);iron(2+)?
The canonical SMILES for carbanide;bis(cyclopentane);iron(2+) is C1CCCC1.C1CCCC1.[CH3-].[CH3-].[Fe+2].
What is the InChIKey of carbanide;bis(cyclopentane);iron(2+)?
The InChIKey is GTAAFKAMYXFIMN-UHFFFAOYSA-N. The full InChI is InChI=1S/2C5H10.2CH3.Fe/c2*1-2-4-5-3-1;;;/h2*1-5H2;2*1H3;/q;;2*-1;+2.
What are the key properties of carbanide;bis(cyclopentane);iron(2+)?
carbanide;bis(cyclopentane);iron(2+) has a molecular weight of 226.18 g/mol, XLogP of 4.80, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;bis(cyclopentane);iron(2+) is sourced from PubChem (CID 162297433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).