1,3,5,7-tetracyclohexyl-1,3,5,7,2λ2,4λ2,6λ2,8λ2-tetrazatetraplumbocane

C24H44N4Pb4 — CID 16688035

IUPAC1,3,5,7-tetracyclohexyl-1,3,5,7,2λ2,4λ2,6λ2,8λ2-tetrazatetraplumbocane
SMILESC1CCC(N2[Pb]N(C3CCCCC3)[Pb]N(C3CCCCC3)[Pb]N(C3CCCCC3)[Pb]2)CC1
InChIInChI=1S/4C6H11N.4Pb/c4*7-6-4-2-1-3-5-6;;;;/h4*6H,1-5H2;;;;
InChIKeyHGPGVQGKPNASFI-UHFFFAOYSA-N
MW1217.44 g/mol
LogP4.68
Rot. Bonds4

About 1,3,5,7-tetracyclohexyl-1,3,5,7,2λ2,4λ2,6λ2,8λ2-tetrazatetraplumbocane

1,3,5,7-tetracyclohexyl-1,3,5,7,2λ2,4λ2,6λ2,8λ2-tetrazatetraplumbocane (PubChem CID 16688035) has the molecular formula C24H44N4Pb4 and a molecular weight of 1217.44 g/mol. Its IUPAC name is 1,3,5,7-tetracyclohexyl-1,3,5,7,2λ2,4λ2,6λ2,8λ2-tetrazatetraplumbocane.

Molecular Properties

Compound Name1,3,5,7-tetracyclohexyl-1,3,5,7,2λ2,4λ2,6λ2,8λ2-tetrazatetraplumbocane
PubChem CID16688035
Molecular FormulaC24H44N4Pb4
Molecular Weight1217.44 g/mol
Exact Mass1220.26
IUPAC Name1,3,5,7-tetracyclohexyl-1,3,5,7,2λ2,4λ2,6λ2,8λ2-tetrazatetraplumbocane
SMILESC1CCC(N2[Pb]N(C3CCCCC3)[Pb]N(C3CCCCC3)[Pb]N(C3CCCCC3)[Pb]2)CC1
InChIInChI=1S/4C6H11N.4Pb/c4*7-6-4-2-1-3-5-6;;;;/h4*6H,1-5H2;;;;
InChIKeyHGPGVQGKPNASFI-UHFFFAOYSA-N
XLogP4.68
TPSA12.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 5001217.44
LogP ≤ 54.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1,3,5,7-tetracyclohexyl-1,3,5,7,2λ2,4λ2,6λ2,8λ2-tetrazatetraplumbocane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1,3,5,7-tetracyclohexyl-1,3,5,7,2λ2,4λ2,6λ2,8λ2-tetrazatetraplumbocane?
The IUPAC name of 1,3,5,7-tetracyclohexyl-1,3,5,7,2λ2,4λ2,6λ2,8λ2-tetrazatetraplumbocane (CID 16688035) is 1,3,5,7-tetracyclohexyl-1,3,5,7,2λ2,4λ2,6λ2,8λ2-tetrazatetraplumbocane.
What is the SMILES notation for 1,3,5,7-tetracyclohexyl-1,3,5,7,2λ2,4λ2,6λ2,8λ2-tetrazatetraplumbocane?
The canonical SMILES for 1,3,5,7-tetracyclohexyl-1,3,5,7,2λ2,4λ2,6λ2,8λ2-tetrazatetraplumbocane is C1CCC(N2[Pb]N(C3CCCCC3)[Pb]N(C3CCCCC3)[Pb]N(C3CCCCC3)[Pb]2)CC1.
What is the InChIKey of 1,3,5,7-tetracyclohexyl-1,3,5,7,2λ2,4λ2,6λ2,8λ2-tetrazatetraplumbocane?
The InChIKey is HGPGVQGKPNASFI-UHFFFAOYSA-N. The full InChI is InChI=1S/4C6H11N.4Pb/c4*7-6-4-2-1-3-5-6;;;;/h4*6H,1-5H2;;;;.
What are the key properties of 1,3,5,7-tetracyclohexyl-1,3,5,7,2λ2,4λ2,6λ2,8λ2-tetrazatetraplumbocane?
1,3,5,7-tetracyclohexyl-1,3,5,7,2λ2,4λ2,6λ2,8λ2-tetrazatetraplumbocane has a molecular weight of 1217.44 g/mol, XLogP of 4.68, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,5,7-tetracyclohexyl-1,3,5,7,2λ2,4λ2,6λ2,8λ2-tetrazatetraplumbocane is sourced from PubChem (CID 16688035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).