2-amino-2-(hydroxymethyl)propane-1,3-diol;dichlororuthenium;2-pyridin-2-ylpyridine

C14H19Cl2N3O3Ru — CID 87929066

IUPAC2-amino-2-(hydroxymethyl)propane-1,3-diol;dichlororuthenium;2-pyridin-2-ylpyridine
SMILESCl[Ru]Cl.NC(CO)(CO)CO.c1ccc(-c2ccccn2)nc1
InChIInChI=1S/C10H8N2.C4H11NO3.2ClH.Ru/c1-3-7-11-9(5-1)10-6-2-4-8-12-10;5-4(1-6,2-7)3-8;;;/h1-8H;6-8H,1-3,5H2;2*1H;/q;;;;+2/p-2
InChIKeyUFJWKXBHTMISEW-UHFFFAOYSA-L
MW449.30 g/mol
LogP1.18
Rot. Bonds4

About 2-amino-2-(hydroxymethyl)propane-1,3-diol;dichlororuthenium;2-pyridin-2-ylpyridine

2-amino-2-(hydroxymethyl)propane-1,3-diol;dichlororuthenium;2-pyridin-2-ylpyridine (PubChem CID 87929066) has the molecular formula C14H19Cl2N3O3Ru and a molecular weight of 449.30 g/mol. Its IUPAC name is 2-amino-2-(hydroxymethyl)propane-1,3-diol;dichlororuthenium;2-pyridin-2-ylpyridine.

Molecular Properties

Compound Name2-amino-2-(hydroxymethyl)propane-1,3-diol;dichlororuthenium;2-pyridin-2-ylpyridine
PubChem CID87929066
Molecular FormulaC14H19Cl2N3O3Ru
Molecular Weight449.30 g/mol
Exact Mass448.98
IUPAC Name2-amino-2-(hydroxymethyl)propane-1,3-diol;dichlororuthenium;2-pyridin-2-ylpyridine
SMILESCl[Ru]Cl.NC(CO)(CO)CO.c1ccc(-c2ccccn2)nc1
InChIInChI=1S/C10H8N2.C4H11NO3.2ClH.Ru/c1-3-7-11-9(5-1)10-6-2-4-8-12-10;5-4(1-6,2-7)3-8;;;/h1-8H;6-8H,1-3,5H2;2*1H;/q;;;;+2/p-2
InChIKeyUFJWKXBHTMISEW-UHFFFAOYSA-L
XLogP1.18
TPSA112.49 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500449.30
LogP ≤ 51.18
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

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Related Compounds

dichlororuthenium;tris(2-pyridin-2-ylpyridine);pentahydrate
CID 173206951
perchloric acid;2-pyridin-2-ylpyridine
CID 71352928
palladium(2+);bis(2-pyridin-2-ylpyridine);diperchlorate
CID 19810782
2-amino-2-(pyridin-2-ylmethyl)propane-1,3-diol;dihydrochloride
CID 23111151
2-pyridin-2-ylpyridine;dihydroiodide
CID 173445353
tris(2-pyridin-2-ylpyridine);ruthenium
CID 6100643
2-pyridin-2-ylpyridine;hydroiodide
CID 172833113
2-pyridin-2-ylpyridine;ruthenium(2+)
CID 140596360
bis(2-pyridin-2-ylpyridine);ruthenium
CID 87118114
nickel;tris(2-pyridin-2-ylpyridine)
CID 76737267
2-pyridin-2-ylpyridine;rhenium;tetrachloride
CID 52939847
azane;cobalt(3+);bis(2-pyridin-2-ylpyridine);triperchlorate
CID 139154451

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(hydroxymethyl)propane-1,3-diol;dichlororuthenium;2-pyridin-2-ylpyridine?
The IUPAC name of 2-amino-2-(hydroxymethyl)propane-1,3-diol;dichlororuthenium;2-pyridin-2-ylpyridine (CID 87929066) is 2-amino-2-(hydroxymethyl)propane-1,3-diol;dichlororuthenium;2-pyridin-2-ylpyridine.
What is the SMILES notation for 2-amino-2-(hydroxymethyl)propane-1,3-diol;dichlororuthenium;2-pyridin-2-ylpyridine?
The canonical SMILES for 2-amino-2-(hydroxymethyl)propane-1,3-diol;dichlororuthenium;2-pyridin-2-ylpyridine is Cl[Ru]Cl.NC(CO)(CO)CO.c1ccc(-c2ccccn2)nc1.
What is the InChIKey of 2-amino-2-(hydroxymethyl)propane-1,3-diol;dichlororuthenium;2-pyridin-2-ylpyridine?
The InChIKey is UFJWKXBHTMISEW-UHFFFAOYSA-L. The full InChI is InChI=1S/C10H8N2.C4H11NO3.2ClH.Ru/c1-3-7-11-9(5-1)10-6-2-4-8-12-10;5-4(1-6,2-7)3-8;;;/h1-8H;6-8H,1-3,5H2;2*1H;/q;;;;+2/p-2.
What are the key properties of 2-amino-2-(hydroxymethyl)propane-1,3-diol;dichlororuthenium;2-pyridin-2-ylpyridine?
2-amino-2-(hydroxymethyl)propane-1,3-diol;dichlororuthenium;2-pyridin-2-ylpyridine has a molecular weight of 449.30 g/mol, XLogP of 1.18, 4 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(hydroxymethyl)propane-1,3-diol;dichlororuthenium;2-pyridin-2-ylpyridine is sourced from PubChem (CID 87929066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).