bis(lead(2+));bis(2-methyl-6-pyridin-2-ylpyridine);tetranitrate

C22H20N8O12Pb2 — CID 139077387

IUPACbis(lead(2+));bis(2-methyl-6-pyridin-2-ylpyridine);tetranitrate
SMILESCc1cccc(-c2ccccn2)n1.Cc1cccc(-c2ccccn2)n1.O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Pb+2].[Pb+2]
InChIInChI=1S/2C11H10N2.4NO3.2Pb/c2*1-9-5-4-7-11(13-9)10-6-2-3-8-12-10;4*2-1(3)4;;/h2*2-8H,1H3;;;;;;/q;;4*-1;2*+2
InChIKeyBFPLLSNVRVCQFD-UHFFFAOYSA-N
MW1002.85 g/mol
LogP3.19
Rot. Bonds2

About bis(lead(2+));bis(2-methyl-6-pyridin-2-ylpyridine);tetranitrate

bis(lead(2+));bis(2-methyl-6-pyridin-2-ylpyridine);tetranitrate (PubChem CID 139077387) has the molecular formula C22H20N8O12Pb2 and a molecular weight of 1002.85 g/mol. Its IUPAC name is bis(lead(2+));bis(2-methyl-6-pyridin-2-ylpyridine);tetranitrate.

Molecular Properties

Compound Namebis(lead(2+));bis(2-methyl-6-pyridin-2-ylpyridine);tetranitrate
PubChem CID139077387
Molecular FormulaC22H20N8O12Pb2
Molecular Weight1002.85 g/mol
Exact Mass1004.07
IUPAC Namebis(lead(2+));bis(2-methyl-6-pyridin-2-ylpyridine);tetranitrate
SMILESCc1cccc(-c2ccccn2)n1.Cc1cccc(-c2ccccn2)n1.O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Pb+2].[Pb+2]
InChIInChI=1S/2C11H10N2.4NO3.2Pb/c2*1-9-5-4-7-11(13-9)10-6-2-3-8-12-10;4*2-1(3)4;;/h2*2-8H,1H3;;;;;;/q;;4*-1;2*+2
InChIKeyBFPLLSNVRVCQFD-UHFFFAOYSA-N
XLogP3.19
TPSA316.36 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds2
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001002.85
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N,N,N',N'-Tetrakis(2-pyridylmethyl)ethylenediamine
CID 5519
tris(2,2'-bipyridyl)cobalt(III)
CID 161059
Iron, tris(2,2'-bipyridine-kappaN1,kappaN1')-, (OC-6-11)-
CID 3032636
cis-Dichlorobis(2,2'-bipyridine)ruthenium(II) dihydrate
CID 2734543
cis-Bis(2,2'-bipyridyl)dichlororuthenium(II)
CID 6398695
cis-Bis(2,2'-bipyridine)dichlororuthenium(II) hydrate
CID 16211844
dichlorobis(2,2'-bipyridyl)chromium(III)
CID 147008
Tris(2,2a(2)-bipyridyl)dichlororuthenium(II) hexahydrate
CID 165340051
Iron(2+), tris(2,2'-bipyridine-kappaN1,kappaN1')-, (OC-6-11)-, perchlorate (1:2)
CID 84889
Tris(2,2'-bipyridyl)-Fe(II) complex
CID 193497
Ruthenium(2+), dichlorotetrakis(2-pyridyl)-, dihydrate (Z)-
CID 3054377
2,2':6',2''-Terpyridine, 6,6'''-(3-hexene-1,6-diyl)bis-
CID 6446331

Frequently Asked Questions

What is the IUPAC name of bis(lead(2+));bis(2-methyl-6-pyridin-2-ylpyridine);tetranitrate?
The IUPAC name of bis(lead(2+));bis(2-methyl-6-pyridin-2-ylpyridine);tetranitrate (CID 139077387) is bis(lead(2+));bis(2-methyl-6-pyridin-2-ylpyridine);tetranitrate.
What is the SMILES notation for bis(lead(2+));bis(2-methyl-6-pyridin-2-ylpyridine);tetranitrate?
The canonical SMILES for bis(lead(2+));bis(2-methyl-6-pyridin-2-ylpyridine);tetranitrate is Cc1cccc(-c2ccccn2)n1.Cc1cccc(-c2ccccn2)n1.O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Pb+2].[Pb+2].
What is the InChIKey of bis(lead(2+));bis(2-methyl-6-pyridin-2-ylpyridine);tetranitrate?
The InChIKey is BFPLLSNVRVCQFD-UHFFFAOYSA-N. The full InChI is InChI=1S/2C11H10N2.4NO3.2Pb/c2*1-9-5-4-7-11(13-9)10-6-2-3-8-12-10;4*2-1(3)4;;/h2*2-8H,1H3;;;;;;/q;;4*-1;2*+2.
What are the key properties of bis(lead(2+));bis(2-methyl-6-pyridin-2-ylpyridine);tetranitrate?
bis(lead(2+));bis(2-methyl-6-pyridin-2-ylpyridine);tetranitrate has a molecular weight of 1002.85 g/mol, XLogP of 3.19, 2 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for bis(lead(2+));bis(2-methyl-6-pyridin-2-ylpyridine);tetranitrate is sourced from PubChem (CID 139077387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).