3-(1-benzylpyrazol-3-yl)-2,6-dimethylimidazo[1,2-a]pyridine

C19H18N4 — CID 70687246

IUPAC3-(1-benzylpyrazol-3-yl)-2,6-dimethylimidazo[1,2-a]pyridine
SMILESCc1ccc2nc(C)c(-c3ccn(Cc4ccccc4)n3)n2c1
InChIInChI=1S/C19H18N4/c1-14-8-9-18-20-15(2)19(23(18)12-14)17-10-11-22(21-17)13-16-6-4-3-5-7-16/h3-12H,13H2,1-2H3
InChIKeyOORSNEDYAQMZLO-UHFFFAOYSA-N
MW302.38 g/mol
LogP3.86
Rot. Bonds3

About 3-(1-benzylpyrazol-3-yl)-2,6-dimethylimidazo[1,2-a]pyridine

3-(1-benzylpyrazol-3-yl)-2,6-dimethylimidazo[1,2-a]pyridine (PubChem CID 70687246) has the molecular formula C19H18N4 and a molecular weight of 302.38 g/mol. Its IUPAC name is 3-(1-benzylpyrazol-3-yl)-2,6-dimethylimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name3-(1-benzylpyrazol-3-yl)-2,6-dimethylimidazo[1,2-a]pyridine
PubChem CID70687246
Molecular FormulaC19H18N4
Molecular Weight302.38 g/mol
Exact Mass302.15
IUPAC Name3-(1-benzylpyrazol-3-yl)-2,6-dimethylimidazo[1,2-a]pyridine
SMILESCc1ccc2nc(C)c(-c3ccn(Cc4ccccc4)n3)n2c1
InChIInChI=1S/C19H18N4/c1-14-8-9-18-20-15(2)19(23(18)12-14)17-10-11-22(21-17)13-16-6-4-3-5-7-16/h3-12H,13H2,1-2H3
InChIKeyOORSNEDYAQMZLO-UHFFFAOYSA-N
XLogP3.86
TPSA35.12 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.38
LogP ≤ 53.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(1-benzylpyrazol-3-yl)-2,6-dimethylimidazo[1,2-a]pyridine?
The IUPAC name of 3-(1-benzylpyrazol-3-yl)-2,6-dimethylimidazo[1,2-a]pyridine (CID 70687246) is 3-(1-benzylpyrazol-3-yl)-2,6-dimethylimidazo[1,2-a]pyridine.
What is the SMILES notation for 3-(1-benzylpyrazol-3-yl)-2,6-dimethylimidazo[1,2-a]pyridine?
The canonical SMILES for 3-(1-benzylpyrazol-3-yl)-2,6-dimethylimidazo[1,2-a]pyridine is Cc1ccc2nc(C)c(-c3ccn(Cc4ccccc4)n3)n2c1.
What is the InChIKey of 3-(1-benzylpyrazol-3-yl)-2,6-dimethylimidazo[1,2-a]pyridine?
The InChIKey is OORSNEDYAQMZLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4/c1-14-8-9-18-20-15(2)19(23(18)12-14)17-10-11-22(21-17)13-16-6-4-3-5-7-16/h3-12H,13H2,1-2H3.
What are the key properties of 3-(1-benzylpyrazol-3-yl)-2,6-dimethylimidazo[1,2-a]pyridine?
3-(1-benzylpyrazol-3-yl)-2,6-dimethylimidazo[1,2-a]pyridine has a molecular weight of 302.38 g/mol, XLogP of 3.86, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-benzylpyrazol-3-yl)-2,6-dimethylimidazo[1,2-a]pyridine is sourced from PubChem (CID 70687246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).