3-(3,4-dimethoxyphenyl)-1-pyridin-2-ylimidazo[1,5-a]pyridine

C20H17N3O2 — CID 139173944

IUPAC3-(3,4-dimethoxyphenyl)-1-pyridin-2-ylimidazo[1,5-a]pyridine
SMILESCOc1ccc(-c2nc(-c3ccccn3)c3ccccn23)cc1OC
InChIInChI=1S/C20H17N3O2/c1-24-17-10-9-14(13-18(17)25-2)20-22-19(15-7-3-5-11-21-15)16-8-4-6-12-23(16)20/h3-13H,1-2H3
InChIKeyDQPCFDVOUBHZOH-UHFFFAOYSA-N
MW331.38 g/mol
LogP4.08
Rot. Bonds4

About 3-(3,4-dimethoxyphenyl)-1-pyridin-2-ylimidazo[1,5-a]pyridine

3-(3,4-dimethoxyphenyl)-1-pyridin-2-ylimidazo[1,5-a]pyridine (PubChem CID 139173944) has the molecular formula C20H17N3O2 and a molecular weight of 331.38 g/mol. Its IUPAC name is 3-(3,4-dimethoxyphenyl)-1-pyridin-2-ylimidazo[1,5-a]pyridine.

Molecular Properties

Compound Name3-(3,4-dimethoxyphenyl)-1-pyridin-2-ylimidazo[1,5-a]pyridine
PubChem CID139173944
Molecular FormulaC20H17N3O2
Molecular Weight331.38 g/mol
Exact Mass331.13
IUPAC Name3-(3,4-dimethoxyphenyl)-1-pyridin-2-ylimidazo[1,5-a]pyridine
SMILESCOc1ccc(-c2nc(-c3ccccn3)c3ccccn23)cc1OC
InChIInChI=1S/C20H17N3O2/c1-24-17-10-9-14(13-18(17)25-2)20-22-19(15-7-3-5-11-21-15)16-8-4-6-12-23(16)20/h3-13H,1-2H3
InChIKeyDQPCFDVOUBHZOH-UHFFFAOYSA-N
XLogP4.08
TPSA48.65 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.38
LogP ≤ 54.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

3-(3-methylphenyl)-1-pyridin-2-ylimidazo[1,5-a]pyridine
CID 11737712
1-bromo-3-(3,4-dimethoxyphenyl)imidazo[1,5-a]pyridine
CID 28798088
1-[3,5-bis(3-pyridin-2-ylimidazo[1,5-a]pyridin-1-yl)phenyl]-3-pyridin-2-ylimidazo[1,5-a]pyridine
CID 118322669
3-pyridin-2-yl-1-[5-(3-pyridin-2-ylimidazo[1,5-a]pyridin-1-yl)-1H-pyrrol-2-yl]imidazo[1,5-a]pyridine
CID 118322664
2-(3,4-dimethoxyphenyl)-4-pyridin-2-yl-1,3-thiazole
CID 18707182
1-bromo-3-(3,4-dimethoxyphenyl)-7-methylimidazo[1,5-a]pyridine
CID 84745416
3-(4-amino-3-methoxyphenyl)imidazo[1,5-a]pyridine-1-carbonitrile
CID 84760106
1-(4-methylphenyl)-3-[1-(4-methylphenyl)imidazo[1,5-a]pyridin-3-yl]imidazo[1,5-a]pyridine
CID 132965985
3-pyridin-2-yl-1-[11-(3-pyridin-2-ylimidazo[1,5-a]pyridin-1-yl)-4,12-dithiapentacyclo[8.6.1.12,5.013,17.09,18]octadeca-1(17),2,5,7,9(18),10,13,15-octaen-3-yl]imidazo[1,5-a]pyridine
CID 118322675
4-chloro-2-[1-(3-methoxy-2-pyridinyl)imidazo[1,5-a]pyridin-3-yl]phenol
CID 155115100
2-chloro-3-(3,4-dimethoxyphenyl)pyridine
CID 82087270
6-fluoro-3-methoxy-2-pyridin-2-ylpyridine
CID 68829591

Frequently Asked Questions

What is the IUPAC name of 3-(3,4-dimethoxyphenyl)-1-pyridin-2-ylimidazo[1,5-a]pyridine?
The IUPAC name of 3-(3,4-dimethoxyphenyl)-1-pyridin-2-ylimidazo[1,5-a]pyridine (CID 139173944) is 3-(3,4-dimethoxyphenyl)-1-pyridin-2-ylimidazo[1,5-a]pyridine.
What is the SMILES notation for 3-(3,4-dimethoxyphenyl)-1-pyridin-2-ylimidazo[1,5-a]pyridine?
The canonical SMILES for 3-(3,4-dimethoxyphenyl)-1-pyridin-2-ylimidazo[1,5-a]pyridine is COc1ccc(-c2nc(-c3ccccn3)c3ccccn23)cc1OC.
What is the InChIKey of 3-(3,4-dimethoxyphenyl)-1-pyridin-2-ylimidazo[1,5-a]pyridine?
The InChIKey is DQPCFDVOUBHZOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N3O2/c1-24-17-10-9-14(13-18(17)25-2)20-22-19(15-7-3-5-11-21-15)16-8-4-6-12-23(16)20/h3-13H,1-2H3.
What are the key properties of 3-(3,4-dimethoxyphenyl)-1-pyridin-2-ylimidazo[1,5-a]pyridine?
3-(3,4-dimethoxyphenyl)-1-pyridin-2-ylimidazo[1,5-a]pyridine has a molecular weight of 331.38 g/mol, XLogP of 4.08, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,4-dimethoxyphenyl)-1-pyridin-2-ylimidazo[1,5-a]pyridine is sourced from PubChem (CID 139173944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).