2-(1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine;2-pyrazol-2-id-3-ylpyridine;2-pyridin-2-ylpyridine;ruthenium(2+)

C25H19N9Ru — CID 58510473

IUPAC2-(1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine;2-pyrazol-2-id-3-ylpyridine;2-pyridin-2-ylpyridine;ruthenium(2+)
SMILES[Ru+2].c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccn[n-]2)nc1.c1ccc(-c2ncn[n-]2)nc1
InChIInChI=1S/C10H8N2.C8H6N3.C7H5N4.Ru/c1-3-7-11-9(5-1)10-6-2-4-8-12-10;1-2-5-9-7(3-1)8-4-6-10-11-8;1-2-4-8-6(3-1)7-9-5-10-11-7;/h1-8H;1-6H;1-5H;/q;2*-1;+2
InChIKeyKUDIMMRQAROHKS-UHFFFAOYSA-N
MW546.56 g/mol
LogP3.74
Rot. Bonds3

About 2-(1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine;2-pyrazol-2-id-3-ylpyridine;2-pyridin-2-ylpyridine;ruthenium(2+)

2-(1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine;2-pyrazol-2-id-3-ylpyridine;2-pyridin-2-ylpyridine;ruthenium(2+) (PubChem CID 58510473) has the molecular formula C25H19N9Ru and a molecular weight of 546.56 g/mol. Its IUPAC name is 2-(1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine;2-pyrazol-2-id-3-ylpyridine;2-pyridin-2-ylpyridine;ruthenium(2+).

Molecular Properties

Compound Name2-(1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine;2-pyrazol-2-id-3-ylpyridine;2-pyridin-2-ylpyridine;ruthenium(2+)
PubChem CID58510473
Molecular FormulaC25H19N9Ru
Molecular Weight546.56 g/mol
Exact Mass547.08
IUPAC Name2-(1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine;2-pyrazol-2-id-3-ylpyridine;2-pyridin-2-ylpyridine;ruthenium(2+)
SMILES[Ru+2].c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccn[n-]2)nc1.c1ccc(-c2ncn[n-]2)nc1
InChIInChI=1S/C10H8N2.C8H6N3.C7H5N4.Ru/c1-3-7-11-9(5-1)10-6-2-4-8-12-10;1-2-5-9-7(3-1)8-4-6-10-11-8;1-2-4-8-6(3-1)7-9-5-10-11-7;/h1-8H;1-6H;1-5H;/q;2*-1;+2
InChIKeyKUDIMMRQAROHKS-UHFFFAOYSA-N
XLogP3.74
TPSA118.43 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms35
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500546.56
LogP ≤ 53.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-(1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine;2-pyrazol-2-id-3-ylpyridine;2-pyridin-2-ylpyridine;ruthenium(2+)?
The IUPAC name of 2-(1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine;2-pyrazol-2-id-3-ylpyridine;2-pyridin-2-ylpyridine;ruthenium(2+) (CID 58510473) is 2-(1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine;2-pyrazol-2-id-3-ylpyridine;2-pyridin-2-ylpyridine;ruthenium(2+).
What is the SMILES notation for 2-(1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine;2-pyrazol-2-id-3-ylpyridine;2-pyridin-2-ylpyridine;ruthenium(2+)?
The canonical SMILES for 2-(1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine;2-pyrazol-2-id-3-ylpyridine;2-pyridin-2-ylpyridine;ruthenium(2+) is [Ru+2].c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccn[n-]2)nc1.c1ccc(-c2ncn[n-]2)nc1.
What is the InChIKey of 2-(1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine;2-pyrazol-2-id-3-ylpyridine;2-pyridin-2-ylpyridine;ruthenium(2+)?
The InChIKey is KUDIMMRQAROHKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N2.C8H6N3.C7H5N4.Ru/c1-3-7-11-9(5-1)10-6-2-4-8-12-10;1-2-5-9-7(3-1)8-4-6-10-11-8;1-2-4-8-6(3-1)7-9-5-10-11-7;/h1-8H;1-6H;1-5H;/q;2*-1;+2.
What are the key properties of 2-(1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine;2-pyrazol-2-id-3-ylpyridine;2-pyridin-2-ylpyridine;ruthenium(2+)?
2-(1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine;2-pyrazol-2-id-3-ylpyridine;2-pyridin-2-ylpyridine;ruthenium(2+) has a molecular weight of 546.56 g/mol, XLogP of 3.74, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl)pyridine;2-pyrazol-2-id-3-ylpyridine;2-pyridin-2-ylpyridine;ruthenium(2+) is sourced from PubChem (CID 58510473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).