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

C25H52Fe2 — CID 162297269

IUPACcarbanide;bis(cyclopentane);cyclopentylmethylcyclopentane;bis(iron(2+))
SMILESC1CCC(CC2CCCC2)C1.C1CCCC1.C1CCCC1.[CH3-].[CH3-].[CH3-].[CH3-].[Fe+2].[Fe+2]
InChIInChI=1S/C11H20.2C5H10.4CH3.2Fe/c1-2-6-10(5-1)9-11-7-3-4-8-11;2*1-2-4-5-3-1;;;;;;/h10-11H,1-9H2;2*1-5H2;4*1H3;;/q;;;4*-1;2*+2
InChIKeyVAUZSRVCNSWNBO-UHFFFAOYSA-N
MW464.38 g/mol
LogP9.45
Rot. Bonds2

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

carbanide;bis(cyclopentane);cyclopentylmethylcyclopentane;bis(iron(2+)) (PubChem CID 162297269) has the molecular formula C25H52Fe2 and a molecular weight of 464.38 g/mol. Its IUPAC name is carbanide;bis(cyclopentane);cyclopentylmethylcyclopentane;bis(iron(2+)).

Molecular Properties

Compound Namecarbanide;bis(cyclopentane);cyclopentylmethylcyclopentane;bis(iron(2+))
PubChem CID162297269
Molecular FormulaC25H52Fe2
Molecular Weight464.38 g/mol
Exact Mass464.28
IUPAC Namecarbanide;bis(cyclopentane);cyclopentylmethylcyclopentane;bis(iron(2+))
SMILESC1CCC(CC2CCCC2)C1.C1CCCC1.C1CCCC1.[CH3-].[CH3-].[CH3-].[CH3-].[Fe+2].[Fe+2]
InChIInChI=1S/C11H20.2C5H10.4CH3.2Fe/c1-2-6-10(5-1)9-11-7-3-4-8-11;2*1-2-4-5-3-1;;;;;;/h10-11H,1-9H2;2*1-5H2;4*1H3;;/q;;;4*-1;2*+2
InChIKeyVAUZSRVCNSWNBO-UHFFFAOYSA-N
XLogP9.45
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500464.38
LogP ≤ 59.45
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

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CID 21015071
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CID 3523250
1-cyclohexyl-4-(cyclopropylmethyl)cyclohexane
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1-(cyclohexylmethyl)-4-methylcyclohexane;ethane;methylcyclohexane
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Frequently Asked Questions

What is the IUPAC name of carbanide;bis(cyclopentane);cyclopentylmethylcyclopentane;bis(iron(2+))?
The IUPAC name of carbanide;bis(cyclopentane);cyclopentylmethylcyclopentane;bis(iron(2+)) (CID 162297269) is carbanide;bis(cyclopentane);cyclopentylmethylcyclopentane;bis(iron(2+)).
What is the SMILES notation for carbanide;bis(cyclopentane);cyclopentylmethylcyclopentane;bis(iron(2+))?
The canonical SMILES for carbanide;bis(cyclopentane);cyclopentylmethylcyclopentane;bis(iron(2+)) is C1CCC(CC2CCCC2)C1.C1CCCC1.C1CCCC1.[CH3-].[CH3-].[CH3-].[CH3-].[Fe+2].[Fe+2].
What is the InChIKey of carbanide;bis(cyclopentane);cyclopentylmethylcyclopentane;bis(iron(2+))?
The InChIKey is VAUZSRVCNSWNBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20.2C5H10.4CH3.2Fe/c1-2-6-10(5-1)9-11-7-3-4-8-11;2*1-2-4-5-3-1;;;;;;/h10-11H,1-9H2;2*1-5H2;4*1H3;;/q;;;4*-1;2*+2.
What are the key properties of carbanide;bis(cyclopentane);cyclopentylmethylcyclopentane;bis(iron(2+))?
carbanide;bis(cyclopentane);cyclopentylmethylcyclopentane;bis(iron(2+)) has a molecular weight of 464.38 g/mol, XLogP of 9.45, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;bis(cyclopentane);cyclopentylmethylcyclopentane;bis(iron(2+)) is sourced from PubChem (CID 162297269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).