carbanide;cyclopentane;cyclopentylphosphane;iron(2+)

C12H27FeP — CID 164886724

IUPACcarbanide;cyclopentane;cyclopentylphosphane;iron(2+)
SMILESC1CCCC1.PC1CCCC1.[CH3-].[CH3-].[Fe+2]
InChIInChI=1S/C5H11P.C5H10.2CH3.Fe/c6-5-3-1-2-4-5;1-2-4-5-3-1;;;/h5H,1-4,6H2;1-5H2;2*1H3;/q;;2*-1;+2
InChIKeyZRLFYTCBMBEXGC-UHFFFAOYSA-N
MW258.17 g/mol
LogP4.65
Rot. Bonds

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

carbanide;cyclopentane;cyclopentylphosphane;iron(2+) (PubChem CID 164886724) has the molecular formula C12H27FeP and a molecular weight of 258.17 g/mol. Its IUPAC name is carbanide;cyclopentane;cyclopentylphosphane;iron(2+).

Molecular Properties

Compound Namecarbanide;cyclopentane;cyclopentylphosphane;iron(2+)
PubChem CID164886724
Molecular FormulaC12H27FeP
Molecular Weight258.17 g/mol
Exact Mass258.12
IUPAC Namecarbanide;cyclopentane;cyclopentylphosphane;iron(2+)
SMILESC1CCCC1.PC1CCCC1.[CH3-].[CH3-].[Fe+2]
InChIInChI=1S/C5H11P.C5H10.2CH3.Fe/c6-5-3-1-2-4-5;1-2-4-5-3-1;;;/h5H,1-4,6H2;1-5H2;2*1H3;/q;;2*-1;+2
InChIKeyZRLFYTCBMBEXGC-UHFFFAOYSA-N
XLogP4.65
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.17
LogP ≤ 54.65
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'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of carbanide;cyclopentane;cyclopentylphosphane;iron(2+)?
The IUPAC name of carbanide;cyclopentane;cyclopentylphosphane;iron(2+) (CID 164886724) is carbanide;cyclopentane;cyclopentylphosphane;iron(2+).
What is the SMILES notation for carbanide;cyclopentane;cyclopentylphosphane;iron(2+)?
The canonical SMILES for carbanide;cyclopentane;cyclopentylphosphane;iron(2+) is C1CCCC1.PC1CCCC1.[CH3-].[CH3-].[Fe+2].
What is the InChIKey of carbanide;cyclopentane;cyclopentylphosphane;iron(2+)?
The InChIKey is ZRLFYTCBMBEXGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11P.C5H10.2CH3.Fe/c6-5-3-1-2-4-5;1-2-4-5-3-1;;;/h5H,1-4,6H2;1-5H2;2*1H3;/q;;2*-1;+2.
What are the key properties of carbanide;cyclopentane;cyclopentylphosphane;iron(2+)?
carbanide;cyclopentane;cyclopentylphosphane;iron(2+) has a molecular weight of 258.17 g/mol, XLogP of 4.65, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;cyclopentane;cyclopentylphosphane;iron(2+) is sourced from PubChem (CID 164886724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).