silver;tetrakis(N-pyridin-2-ylpyridin-2-amine);nitrate

C40H36AgN13O3 — CID 139086290

IUPACsilver;tetrakis(N-pyridin-2-ylpyridin-2-amine);nitrate
SMILESO=[N+]([O-])[O-].[Ag+].c1ccc(Nc2ccccn2)nc1.c1ccc(Nc2ccccn2)nc1.c1ccc(Nc2ccccn2)nc1.c1ccc(Nc2ccccn2)nc1
InChIInChI=1S/4C10H9N3.Ag.NO3/c4*1-3-7-11-9(5-1)13-10-6-2-4-8-12-10;;2-1(3)4/h4*1-8H,(H,11,12,13);;/q;;;;+1;-1
InChIKeyRBNNMBUXLXRQEO-UHFFFAOYSA-N
MW854.68 g/mol
LogP8.64
Rot. Bonds8

About silver;tetrakis(N-pyridin-2-ylpyridin-2-amine);nitrate

silver;tetrakis(N-pyridin-2-ylpyridin-2-amine);nitrate (PubChem CID 139086290) has the molecular formula C40H36AgN13O3 and a molecular weight of 854.68 g/mol. Its IUPAC name is silver;tetrakis(N-pyridin-2-ylpyridin-2-amine);nitrate.

Molecular Properties

Compound Namesilver;tetrakis(N-pyridin-2-ylpyridin-2-amine);nitrate
PubChem CID139086290
Molecular FormulaC40H36AgN13O3
Molecular Weight854.68 g/mol
Exact Mass853.21
IUPAC Namesilver;tetrakis(N-pyridin-2-ylpyridin-2-amine);nitrate
SMILESO=[N+]([O-])[O-].[Ag+].c1ccc(Nc2ccccn2)nc1.c1ccc(Nc2ccccn2)nc1.c1ccc(Nc2ccccn2)nc1.c1ccc(Nc2ccccn2)nc1
InChIInChI=1S/4C10H9N3.Ag.NO3/c4*1-3-7-11-9(5-1)13-10-6-2-4-8-12-10;;2-1(3)4/h4*1-8H,(H,11,12,13);;/q;;;;+1;-1
InChIKeyRBNNMBUXLXRQEO-UHFFFAOYSA-N
XLogP8.64
TPSA217.44 Ų
H-Bond Donors4
H-Bond Acceptors15
Rotatable Bonds8
Heavy Atoms57
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 500854.68
LogP ≤ 58.64
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1015

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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Frequently Asked Questions

What is the IUPAC name of silver;tetrakis(N-pyridin-2-ylpyridin-2-amine);nitrate?
The IUPAC name of silver;tetrakis(N-pyridin-2-ylpyridin-2-amine);nitrate (CID 139086290) is silver;tetrakis(N-pyridin-2-ylpyridin-2-amine);nitrate.
What is the SMILES notation for silver;tetrakis(N-pyridin-2-ylpyridin-2-amine);nitrate?
The canonical SMILES for silver;tetrakis(N-pyridin-2-ylpyridin-2-amine);nitrate is O=[N+]([O-])[O-].[Ag+].c1ccc(Nc2ccccn2)nc1.c1ccc(Nc2ccccn2)nc1.c1ccc(Nc2ccccn2)nc1.c1ccc(Nc2ccccn2)nc1.
What is the InChIKey of silver;tetrakis(N-pyridin-2-ylpyridin-2-amine);nitrate?
The InChIKey is RBNNMBUXLXRQEO-UHFFFAOYSA-N. The full InChI is InChI=1S/4C10H9N3.Ag.NO3/c4*1-3-7-11-9(5-1)13-10-6-2-4-8-12-10;;2-1(3)4/h4*1-8H,(H,11,12,13);;/q;;;;+1;-1.
What are the key properties of silver;tetrakis(N-pyridin-2-ylpyridin-2-amine);nitrate?
silver;tetrakis(N-pyridin-2-ylpyridin-2-amine);nitrate has a molecular weight of 854.68 g/mol, XLogP of 8.64, 8 rotatable bonds, 4 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for silver;tetrakis(N-pyridin-2-ylpyridin-2-amine);nitrate is sourced from PubChem (CID 139086290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).