tetrapentylplumbane

C20H44Pb — CID 15642144

IUPACtetrapentylplumbane
SMILESCCCCC[Pb](CCCCC)(CCCCC)CCCCC
InChIInChI=1S/4C5H11.Pb/c4*1-3-5-4-2;/h4*1,3-5H2,2H3;
InChIKeyTUGRZABPBFMBSA-UHFFFAOYSA-N
MW491.77 g/mol
LogP8.20
Rot. Bonds16

About tetrapentylplumbane

tetrapentylplumbane (PubChem CID 15642144) has the molecular formula C20H44Pb and a molecular weight of 491.77 g/mol. Its IUPAC name is tetrapentylplumbane.

Molecular Properties

Compound Nametetrapentylplumbane
PubChem CID15642144
Molecular FormulaC20H44Pb
Molecular Weight491.77 g/mol
Exact Mass492.32
IUPAC Nametetrapentylplumbane
SMILESCCCCC[Pb](CCCCC)(CCCCC)CCCCC
InChIInChI=1S/4C5H11.Pb/c4*1-3-5-4-2;/h4*1,3-5H2,2H3;
InChIKeyTUGRZABPBFMBSA-UHFFFAOYSA-N
XLogP8.20
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds16
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500491.77
LogP ≤ 58.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of tetrapentylplumbane?
The IUPAC name of tetrapentylplumbane (CID 15642144) is tetrapentylplumbane.
What is the SMILES notation for tetrapentylplumbane?
The canonical SMILES for tetrapentylplumbane is CCCCC[Pb](CCCCC)(CCCCC)CCCCC.
What is the InChIKey of tetrapentylplumbane?
The InChIKey is TUGRZABPBFMBSA-UHFFFAOYSA-N. The full InChI is InChI=1S/4C5H11.Pb/c4*1-3-5-4-2;/h4*1,3-5H2,2H3;.
What are the key properties of tetrapentylplumbane?
tetrapentylplumbane has a molecular weight of 491.77 g/mol, XLogP of 8.20, 16 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tetrapentylplumbane is sourced from PubChem (CID 15642144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).