calcium;2,3-dipyridin-3-ylpyridine;hydride

C15H13CaN3 — CID 174847287

IUPACcalcium;2,3-dipyridin-3-ylpyridine;hydride
SMILES[Ca+2].[H-].[H-].c1cncc(-c2cccnc2-c2cccnc2)c1
InChIInChI=1S/C15H11N3.Ca.2H/c1-4-12(10-16-7-1)14-6-3-9-18-15(14)13-5-2-8-17-11-13;;;/h1-11H;;;/q;+2;2*-1
InChIKeyRKRKDVFRJWGREI-UHFFFAOYSA-N
MW275.37 g/mol
LogP3.05
Rot. Bonds2

About calcium;2,3-dipyridin-3-ylpyridine;hydride

calcium;2,3-dipyridin-3-ylpyridine;hydride (PubChem CID 174847287) has the molecular formula C15H13CaN3 and a molecular weight of 275.37 g/mol. Its IUPAC name is calcium;2,3-dipyridin-3-ylpyridine;hydride.

Molecular Properties

Compound Namecalcium;2,3-dipyridin-3-ylpyridine;hydride
PubChem CID174847287
Molecular FormulaC15H13CaN3
Molecular Weight275.37 g/mol
Exact Mass275.07
IUPAC Namecalcium;2,3-dipyridin-3-ylpyridine;hydride
SMILES[Ca+2].[H-].[H-].c1cncc(-c2cccnc2-c2cccnc2)c1
InChIInChI=1S/C15H11N3.Ca.2H/c1-4-12(10-16-7-1)14-6-3-9-18-15(14)13-5-2-8-17-11-13;;;/h1-11H;;;/q;+2;2*-1
InChIKeyRKRKDVFRJWGREI-UHFFFAOYSA-N
XLogP3.05
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.37
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2,3-dipyridin-3-ylpyridine;methane
CID 174971096
2,3-dipyridin-3-ylpyridine;hydrobromide
CID 175062851
2,3-dipyridin-3-ylpyridine;ruthenium(3+);trichloride
CID 175008055
2,3-dipyridin-3-ylpyridine;platinum(2+);dibromide
CID 175132894
2,3-dipyridin-3-ylpyridine;ruthenium(3+);trichloride;hexahydrate
CID 175003948
3-phenyl-2-pyridin-3-ylpyridine
CID 140510629
disilver;2,3-dipyridin-3-ylpyridine;dinitrate
CID 174813132
2-iodo-3-pyridin-3-ylpyridine
CID 134338193
2-benzyl-3-(3-pyridin-3-yl-2-pyridinyl)pyridine
CID 175335350
5-fluoro-2,3-dipyridin-3-ylpyridine
CID 46316529
3-(5-pyridin-3-ylnaphthalen-1-yl)pyridine
CID 169050404
diphenyl-(3-pyridin-3-yl-2-pyridinyl)phosphane
CID 87862086

Frequently Asked Questions

What is the IUPAC name of calcium;2,3-dipyridin-3-ylpyridine;hydride?
The IUPAC name of calcium;2,3-dipyridin-3-ylpyridine;hydride (CID 174847287) is calcium;2,3-dipyridin-3-ylpyridine;hydride.
What is the SMILES notation for calcium;2,3-dipyridin-3-ylpyridine;hydride?
The canonical SMILES for calcium;2,3-dipyridin-3-ylpyridine;hydride is [Ca+2].[H-].[H-].c1cncc(-c2cccnc2-c2cccnc2)c1.
What is the InChIKey of calcium;2,3-dipyridin-3-ylpyridine;hydride?
The InChIKey is RKRKDVFRJWGREI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N3.Ca.2H/c1-4-12(10-16-7-1)14-6-3-9-18-15(14)13-5-2-8-17-11-13;;;/h1-11H;;;/q;+2;2*-1.
What are the key properties of calcium;2,3-dipyridin-3-ylpyridine;hydride?
calcium;2,3-dipyridin-3-ylpyridine;hydride has a molecular weight of 275.37 g/mol, XLogP of 3.05, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for calcium;2,3-dipyridin-3-ylpyridine;hydride is sourced from PubChem (CID 174847287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).