ethane;2-(1-methylpyrazol-3-yl)pyridine

C11H15N3 — CID 145203642

IUPACethane;2-(1-methylpyrazol-3-yl)pyridine
SMILESCC.Cn1ccc(-c2ccccn2)n1
InChIInChI=1S/C9H9N3.C2H6/c1-12-7-5-9(11-12)8-4-2-3-6-10-8;1-2/h2-7H,1H3;1-2H3
InChIKeyHSIRCTGIBGDEEG-UHFFFAOYSA-N
MW189.26 g/mol
LogP2.51
Rot. Bonds1

About ethane;2-(1-methylpyrazol-3-yl)pyridine

ethane;2-(1-methylpyrazol-3-yl)pyridine (PubChem CID 145203642) has the molecular formula C11H15N3 and a molecular weight of 189.26 g/mol. Its IUPAC name is ethane;2-(1-methylpyrazol-3-yl)pyridine.

Molecular Properties

Compound Nameethane;2-(1-methylpyrazol-3-yl)pyridine
PubChem CID145203642
Molecular FormulaC11H15N3
Molecular Weight189.26 g/mol
Exact Mass189.13
IUPAC Nameethane;2-(1-methylpyrazol-3-yl)pyridine
SMILESCC.Cn1ccc(-c2ccccn2)n1
InChIInChI=1S/C9H9N3.C2H6/c1-12-7-5-9(11-12)8-4-2-3-6-10-8;1-2/h2-7H,1H3;1-2H3
InChIKeyHSIRCTGIBGDEEG-UHFFFAOYSA-N
XLogP2.51
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 52.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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tris(2-pyridin-2-ylpyridine);ruthenium
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2-pyridin-2-ylpyridine;ruthenium(2+)
CID 140596360
2-pyridin-2-ylpyridine;hydroiodide
CID 172833113
2-pyridin-2-ylpyridine;rhenium;tetrachloride
CID 52939847
2-pyridin-2-ylpyridine;dihydroiodide
CID 173445353
4-methyl-2-(1-methylpyrazol-3-yl)pyridine
CID 130225331
propane;2-pyridin-2-ylpyridine
CID 158168510
disodium;hydride;2-pyridin-2-ylpyridine
CID 174959125
pyrrolo[3,2-b]azepine
CID 66934182

Frequently Asked Questions

What is the IUPAC name of ethane;2-(1-methylpyrazol-3-yl)pyridine?
The IUPAC name of ethane;2-(1-methylpyrazol-3-yl)pyridine (CID 145203642) is ethane;2-(1-methylpyrazol-3-yl)pyridine.
What is the SMILES notation for ethane;2-(1-methylpyrazol-3-yl)pyridine?
The canonical SMILES for ethane;2-(1-methylpyrazol-3-yl)pyridine is CC.Cn1ccc(-c2ccccn2)n1.
What is the InChIKey of ethane;2-(1-methylpyrazol-3-yl)pyridine?
The InChIKey is HSIRCTGIBGDEEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3.C2H6/c1-12-7-5-9(11-12)8-4-2-3-6-10-8;1-2/h2-7H,1H3;1-2H3.
What are the key properties of ethane;2-(1-methylpyrazol-3-yl)pyridine?
ethane;2-(1-methylpyrazol-3-yl)pyridine has a molecular weight of 189.26 g/mol, XLogP of 2.51, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-(1-methylpyrazol-3-yl)pyridine is sourced from PubChem (CID 145203642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).