2-(4,5-dimethyl-1H-pyrazol-3-yl)-6-methylpyridine

C11H13N3 — CID 147261627

IUPAC2-(4,5-dimethyl-1H-pyrazol-3-yl)-6-methylpyridine
SMILESCc1cccc(-c2n[nH]c(C)c2C)n1
InChIInChI=1S/C11H13N3/c1-7-5-4-6-10(12-7)11-8(2)9(3)13-14-11/h4-6H,1-3H3,(H,13,14)
InChIKeyCORCHYCBTGZEJQ-UHFFFAOYSA-N
MW187.25 g/mol
LogP2.40
Rot. Bonds1

About 2-(4,5-dimethyl-1H-pyrazol-3-yl)-6-methylpyridine

2-(4,5-dimethyl-1H-pyrazol-3-yl)-6-methylpyridine (PubChem CID 147261627) has the molecular formula C11H13N3 and a molecular weight of 187.25 g/mol. Its IUPAC name is 2-(4,5-dimethyl-1H-pyrazol-3-yl)-6-methylpyridine.

Molecular Properties

Compound Name2-(4,5-dimethyl-1H-pyrazol-3-yl)-6-methylpyridine
PubChem CID147261627
Molecular FormulaC11H13N3
Molecular Weight187.25 g/mol
Exact Mass187.11
IUPAC Name2-(4,5-dimethyl-1H-pyrazol-3-yl)-6-methylpyridine
SMILESCc1cccc(-c2n[nH]c(C)c2C)n1
InChIInChI=1S/C11H13N3/c1-7-5-4-6-10(12-7)11-8(2)9(3)13-14-11/h4-6H,1-3H3,(H,13,14)
InChIKeyCORCHYCBTGZEJQ-UHFFFAOYSA-N
XLogP2.40
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.25
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4,5-dimethyl-1H-pyrazol-3-yl)-6-methylpyridine?
The IUPAC name of 2-(4,5-dimethyl-1H-pyrazol-3-yl)-6-methylpyridine (CID 147261627) is 2-(4,5-dimethyl-1H-pyrazol-3-yl)-6-methylpyridine.
What is the SMILES notation for 2-(4,5-dimethyl-1H-pyrazol-3-yl)-6-methylpyridine?
The canonical SMILES for 2-(4,5-dimethyl-1H-pyrazol-3-yl)-6-methylpyridine is Cc1cccc(-c2n[nH]c(C)c2C)n1.
What is the InChIKey of 2-(4,5-dimethyl-1H-pyrazol-3-yl)-6-methylpyridine?
The InChIKey is CORCHYCBTGZEJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3/c1-7-5-4-6-10(12-7)11-8(2)9(3)13-14-11/h4-6H,1-3H3,(H,13,14).
What are the key properties of 2-(4,5-dimethyl-1H-pyrazol-3-yl)-6-methylpyridine?
2-(4,5-dimethyl-1H-pyrazol-3-yl)-6-methylpyridine has a molecular weight of 187.25 g/mol, XLogP of 2.40, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,5-dimethyl-1H-pyrazol-3-yl)-6-methylpyridine is sourced from PubChem (CID 147261627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).