8,8'-spirobi[7,9-diaza-8-plumbatricyclo[7.4.0.02,7]tridecane]

C20H36N4Pb — CID 16685450

IUPAC8,8'-spirobi[7,9-diaza-8-plumbatricyclo[7.4.0.02,7]tridecane]
SMILESC1CCN2C(C1)C1CCCCN1[Pb]21N2CCCCC2C2CCCCN21
InChIInChI=1S/2C10H18N2.Pb/c2*1-3-7-11-9(5-1)10-6-2-4-8-12-10;/h2*9-10H,1-8H2;/q2*-2;+4
InChIKeyDKNWOCGZOABNPW-UHFFFAOYSA-N
MW539.74 g/mol
LogP2.87
Rot. Bonds

About 8,8'-spirobi[7,9-diaza-8-plumbatricyclo[7.4.0.02,7]tridecane]

8,8'-spirobi[7,9-diaza-8-plumbatricyclo[7.4.0.02,7]tridecane] (PubChem CID 16685450) has the molecular formula C20H36N4Pb and a molecular weight of 539.74 g/mol. Its IUPAC name is 8,8'-spirobi[7,9-diaza-8-plumbatricyclo[7.4.0.02,7]tridecane].

Molecular Properties

Compound Name8,8'-spirobi[7,9-diaza-8-plumbatricyclo[7.4.0.02,7]tridecane]
PubChem CID16685450
Molecular FormulaC20H36N4Pb
Molecular Weight539.74 g/mol
Exact Mass540.27
IUPAC Name8,8'-spirobi[7,9-diaza-8-plumbatricyclo[7.4.0.02,7]tridecane]
SMILESC1CCN2C(C1)C1CCCCN1[Pb]21N2CCCCC2C2CCCCN21
InChIInChI=1S/2C10H18N2.Pb/c2*1-3-7-11-9(5-1)10-6-2-4-8-12-10;/h2*9-10H,1-8H2;/q2*-2;+4
InChIKeyDKNWOCGZOABNPW-UHFFFAOYSA-N
XLogP2.87
TPSA12.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500539.74
LogP ≤ 52.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 8,8'-spirobi[7,9-diaza-8-plumbatricyclo[7.4.0.02,7]tridecane] with MolForge

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Related Compounds

Bis(2-piperidin-1-id-2-ylpiperidin-1-ide);ruthenium(4+);dinitrite
CID 54602138
Iron(6+);tris(2-piperidin-1-id-2-ylpiperidin-1-ide)
CID 54603514
Dichlorocobalt;bis(2-piperidin-1-id-2-ylpiperidin-1-ide)
CID 54604644
Dichlororuthenium;bis(2-piperidin-1-id-2-ylpiperidin-1-ide)
CID 54612459
Ruthenium tris(2, dichloride
CID 54603649
Iridium;bis(2-piperidin-1-id-2-ylpiperidin-1-ide)
CID 59063314
Carbanide;bis(4-methyl-2-(4-methylpiperidin-1-id-2-yl)piperidin-1-ide);ruthenium(6+)
CID 59582768
Bis(piperidin-1-ide);bis(2-piperidin-1-id-2-ylpiperidin-1-ide);ruthenium(6+)
CID 59919011
8,8'-Spirobi[7,9-diazatricyclo[7.4.0.02,7]tridecane]
CID 59973220
Bis(piperidin-1-ide);bis(2-piperidin-1-id-2-ylpiperidin-1-ide);ruthenium(8+)
CID 140444400
Tris(2-piperidin-1-id-2-ylpiperidin-1-ide);ruthenium(8+)
CID 140482762
Iridium;tris(2-piperidin-1-id-2-ylpiperidin-1-ide)
CID 5250517

Frequently Asked Questions

What is the IUPAC name of 8,8'-spirobi[7,9-diaza-8-plumbatricyclo[7.4.0.02,7]tridecane]?
The IUPAC name of 8,8'-spirobi[7,9-diaza-8-plumbatricyclo[7.4.0.02,7]tridecane] (CID 16685450) is 8,8'-spirobi[7,9-diaza-8-plumbatricyclo[7.4.0.02,7]tridecane].
What is the SMILES notation for 8,8'-spirobi[7,9-diaza-8-plumbatricyclo[7.4.0.02,7]tridecane]?
The canonical SMILES for 8,8'-spirobi[7,9-diaza-8-plumbatricyclo[7.4.0.02,7]tridecane] is C1CCN2C(C1)C1CCCCN1[Pb]21N2CCCCC2C2CCCCN21.
What is the InChIKey of 8,8'-spirobi[7,9-diaza-8-plumbatricyclo[7.4.0.02,7]tridecane]?
The InChIKey is DKNWOCGZOABNPW-UHFFFAOYSA-N. The full InChI is InChI=1S/2C10H18N2.Pb/c2*1-3-7-11-9(5-1)10-6-2-4-8-12-10;/h2*9-10H,1-8H2;/q2*-2;+4.
What are the key properties of 8,8'-spirobi[7,9-diaza-8-plumbatricyclo[7.4.0.02,7]tridecane]?
8,8'-spirobi[7,9-diaza-8-plumbatricyclo[7.4.0.02,7]tridecane] has a molecular weight of 539.74 g/mol, XLogP of 2.87, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8,8'-spirobi[7,9-diaza-8-plumbatricyclo[7.4.0.02,7]tridecane] is sourced from PubChem (CID 16685450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).