2,6-bis(3-methyl-1H-pyrazol-1-yl)pyridine

C13H13N5 — CID 850137

IUPAC2,6-bis(3-methylpyrazol-1-yl)pyridine
SMILESCC1=NN(C=C1)C2=NC(=CC=C2)N3C=CC(=N3)C
InChIInChI=1S/C13H13N5/c1-10-6-8-17(15-10)12-4-3-5-13(14-12)18-9-7-11(2)16-18/h3-9H,1-2H3
InChIKeyRAIXXDUNEZBGDR-UHFFFAOYSA-N
MW239.28 g/mol
LogP2.30
Rot. Bonds2

About 2,6-bis(3-methyl-1H-pyrazol-1-yl)pyridine

2,6-bis(3-methyl-1H-pyrazol-1-yl)pyridine (PubChem CID 850137) has the molecular formula C13H13N5 and a molecular weight of 239.28 g/mol. Its IUPAC name is 2,6-bis(3-methylpyrazol-1-yl)pyridine.

Molecular Properties

Compound Name2,6-bis(3-methyl-1H-pyrazol-1-yl)pyridine
PubChem CID850137
Molecular FormulaC13H13N5
Molecular Weight239.28 g/mol
Exact Mass239.12
IUPAC Name2,6-bis(3-methylpyrazol-1-yl)pyridine
SMILESCC1=NN(C=C1)C2=NC(=CC=C2)N3C=CC(=N3)C
InChIInChI=1S/C13H13N5/c1-10-6-8-17(15-10)12-4-3-5-13(14-12)18-9-7-11(2)16-18/h3-9H,1-2H3
InChIKeyRAIXXDUNEZBGDR-UHFFFAOYSA-N
XLogP2.30
TPSA48.50 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity259

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-Methyl-1-(pyridin-2-yl)-1H-pyrazol-5-amine
CID 735132
2-Methyl-7-(2-pyridinyl)pyrazolo[1,5-a]pyrimidine
CID 610950
2-(3,5-Dimethyl-1H-pyrazol-1-yl)-3-nitropyridine
CID 2740944
3-methyl-4-nitroso-1-(pyridin-2-yl)-1H-pyrazol-5-amine
CID 5138169
2-[3,5-bis(trifluoromethyl)-1H-pyrazol-1-yl]-3-pyridinylamine
CID 1473015
1-Methyl-2-[1,2,3]triazol-2-yl-1H-imidazo[4,5-c]pyridin-4-ylamine
CID 11494318
5,7-Dimethyl-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidine
CID 934656
Pyridine, 2-(4-aminopyrazol-1-yl)-
CID 206681
1-((pyridin-2-yl)methyl)-1H-pyrazol-5-amine
CID 2565951
2-(3,5-dimethyl-1H-pyrazol-1-yl)pyridine
CID 676764
2-(1H-pyrazol-1-yl)pyridine
CID 5324086
6,8-Dichloro-5-methyl-2-[2-(1-methylpyrazol-3-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridine
CID 165415328

Frequently Asked Questions

What is the IUPAC name of 2,6-bis(3-methyl-1H-pyrazol-1-yl)pyridine?
The IUPAC name of 2,6-bis(3-methyl-1H-pyrazol-1-yl)pyridine (CID 850137) is 2,6-bis(3-methylpyrazol-1-yl)pyridine.
What is the SMILES notation for 2,6-bis(3-methyl-1H-pyrazol-1-yl)pyridine?
The canonical SMILES for 2,6-bis(3-methyl-1H-pyrazol-1-yl)pyridine is CC1=NN(C=C1)C2=NC(=CC=C2)N3C=CC(=N3)C.
What is the InChIKey of 2,6-bis(3-methyl-1H-pyrazol-1-yl)pyridine?
The InChIKey is RAIXXDUNEZBGDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N5/c1-10-6-8-17(15-10)12-4-3-5-13(14-12)18-9-7-11(2)16-18/h3-9H,1-2H3.
What are the key properties of 2,6-bis(3-methyl-1H-pyrazol-1-yl)pyridine?
2,6-bis(3-methyl-1H-pyrazol-1-yl)pyridine has a molecular weight of 239.28 g/mol, XLogP of 2.30, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-bis(3-methyl-1H-pyrazol-1-yl)pyridine is sourced from PubChem (CID 850137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).