2-(2,5-dimethylpyrazol-3-yl)-4-methylpyridine

C11H13N3 — CID 139386235

IUPAC2-(2,5-dimethylpyrazol-3-yl)-4-methylpyridine
SMILESCc1ccnc(-c2cc(C)nn2C)c1
InChIInChI=1S/C11H13N3/c1-8-4-5-12-10(6-8)11-7-9(2)13-14(11)3/h4-7H,1-3H3
InChIKeyHFONOBHMCKPVHT-UHFFFAOYSA-N
MW187.25 g/mol
LogP2.10
Rot. Bonds1

About 2-(2,5-dimethylpyrazol-3-yl)-4-methylpyridine

2-(2,5-dimethylpyrazol-3-yl)-4-methylpyridine (PubChem CID 139386235) has the molecular formula C11H13N3 and a molecular weight of 187.25 g/mol. Its IUPAC name is 2-(2,5-dimethylpyrazol-3-yl)-4-methylpyridine.

Molecular Properties

Compound Name2-(2,5-dimethylpyrazol-3-yl)-4-methylpyridine
PubChem CID139386235
Molecular FormulaC11H13N3
Molecular Weight187.25 g/mol
Exact Mass187.11
IUPAC Name2-(2,5-dimethylpyrazol-3-yl)-4-methylpyridine
SMILESCc1ccnc(-c2cc(C)nn2C)c1
InChIInChI=1S/C11H13N3/c1-8-4-5-12-10(6-8)11-7-9(2)13-14(11)3/h4-7H,1-3H3
InChIKeyHFONOBHMCKPVHT-UHFFFAOYSA-N
XLogP2.10
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.25
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylpyrazol-3-yl)-4-methylpyridine?
The IUPAC name of 2-(2,5-dimethylpyrazol-3-yl)-4-methylpyridine (CID 139386235) is 2-(2,5-dimethylpyrazol-3-yl)-4-methylpyridine.
What is the SMILES notation for 2-(2,5-dimethylpyrazol-3-yl)-4-methylpyridine?
The canonical SMILES for 2-(2,5-dimethylpyrazol-3-yl)-4-methylpyridine is Cc1ccnc(-c2cc(C)nn2C)c1.
What is the InChIKey of 2-(2,5-dimethylpyrazol-3-yl)-4-methylpyridine?
The InChIKey is HFONOBHMCKPVHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3/c1-8-4-5-12-10(6-8)11-7-9(2)13-14(11)3/h4-7H,1-3H3.
What are the key properties of 2-(2,5-dimethylpyrazol-3-yl)-4-methylpyridine?
2-(2,5-dimethylpyrazol-3-yl)-4-methylpyridine has a molecular weight of 187.25 g/mol, XLogP of 2.10, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylpyrazol-3-yl)-4-methylpyridine is sourced from PubChem (CID 139386235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).