tri(pyrrol-1-yl)plumbane

C12H13N3Pb — CID 16685171

IUPACtri(pyrrol-1-yl)plumbane
SMILESc1ccn([PbH](n2cccc2)n2cccc2)c1
InChIInChI=1S/3C4H4N.Pb.H/c3*1-2-4-5-3-1;;/h3*1-4H;;/q3*-1;+3;
InChIKeyZSCMWDSRWSDGEE-UHFFFAOYSA-N
MW406.46 g/mol
LogP1.75
Rot. Bonds3

About tri(pyrrol-1-yl)plumbane

tri(pyrrol-1-yl)plumbane (PubChem CID 16685171) has the molecular formula C12H13N3Pb and a molecular weight of 406.46 g/mol. Its IUPAC name is tri(pyrrol-1-yl)plumbane.

Molecular Properties

Compound Nametri(pyrrol-1-yl)plumbane
PubChem CID16685171
Molecular FormulaC12H13N3Pb
Molecular Weight406.46 g/mol
Exact Mass407.09
IUPAC Nametri(pyrrol-1-yl)plumbane
SMILESc1ccn([PbH](n2cccc2)n2cccc2)c1
InChIInChI=1S/3C4H4N.Pb.H/c3*1-2-4-5-3-1;;/h3*1-4H;;/q3*-1;+3;
InChIKeyZSCMWDSRWSDGEE-UHFFFAOYSA-N
XLogP1.75
TPSA14.79 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.46
LogP ≤ 51.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of tri(pyrrol-1-yl)plumbane?
The IUPAC name of tri(pyrrol-1-yl)plumbane (CID 16685171) is tri(pyrrol-1-yl)plumbane.
What is the SMILES notation for tri(pyrrol-1-yl)plumbane?
The canonical SMILES for tri(pyrrol-1-yl)plumbane is c1ccn([PbH](n2cccc2)n2cccc2)c1.
What is the InChIKey of tri(pyrrol-1-yl)plumbane?
The InChIKey is ZSCMWDSRWSDGEE-UHFFFAOYSA-N. The full InChI is InChI=1S/3C4H4N.Pb.H/c3*1-2-4-5-3-1;;/h3*1-4H;;/q3*-1;+3;.
What are the key properties of tri(pyrrol-1-yl)plumbane?
tri(pyrrol-1-yl)plumbane has a molecular weight of 406.46 g/mol, XLogP of 1.75, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tri(pyrrol-1-yl)plumbane is sourced from PubChem (CID 16685171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).