3-(2,4-dimethoxyphenyl)-8-pyrrolidin-1-ylimidazo[1,2-a]pyrazine

C18H20N4O2 — CID 163312851

IUPAC3-(2,4-dimethoxyphenyl)-8-pyrrolidin-1-ylimidazo[1,2-a]pyrazine
SMILESCOc1ccc(-c2cnc3c(N4CCCC4)nccn23)c(OC)c1
InChIInChI=1S/C18H20N4O2/c1-23-13-5-6-14(16(11-13)24-2)15-12-20-18-17(19-7-10-22(15)18)21-8-3-4-9-21/h5-7,10-12H,3-4,8-9H2,1-2H3
InChIKeyNMZQGYQNYCPHAF-UHFFFAOYSA-N
MW324.38 g/mol
LogP3.01
Rot. Bonds4

About 3-(2,4-dimethoxyphenyl)-8-pyrrolidin-1-ylimidazo[1,2-a]pyrazine

3-(2,4-dimethoxyphenyl)-8-pyrrolidin-1-ylimidazo[1,2-a]pyrazine (PubChem CID 163312851) has the molecular formula C18H20N4O2 and a molecular weight of 324.38 g/mol. Its IUPAC name is 3-(2,4-dimethoxyphenyl)-8-pyrrolidin-1-ylimidazo[1,2-a]pyrazine.

Molecular Properties

Compound Name3-(2,4-dimethoxyphenyl)-8-pyrrolidin-1-ylimidazo[1,2-a]pyrazine
PubChem CID163312851
Molecular FormulaC18H20N4O2
Molecular Weight324.38 g/mol
Exact Mass324.16
IUPAC Name3-(2,4-dimethoxyphenyl)-8-pyrrolidin-1-ylimidazo[1,2-a]pyrazine
SMILESCOc1ccc(-c2cnc3c(N4CCCC4)nccn23)c(OC)c1
InChIInChI=1S/C18H20N4O2/c1-23-13-5-6-14(16(11-13)24-2)15-12-20-18-17(19-7-10-22(15)18)21-8-3-4-9-21/h5-7,10-12H,3-4,8-9H2,1-2H3
InChIKeyNMZQGYQNYCPHAF-UHFFFAOYSA-N
XLogP3.01
TPSA51.89 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 53.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-(2,4-dimethoxyphenyl)-8-pyrrolidin-1-ylimidazo[1,2-a]pyrazine?
The IUPAC name of 3-(2,4-dimethoxyphenyl)-8-pyrrolidin-1-ylimidazo[1,2-a]pyrazine (CID 163312851) is 3-(2,4-dimethoxyphenyl)-8-pyrrolidin-1-ylimidazo[1,2-a]pyrazine.
What is the SMILES notation for 3-(2,4-dimethoxyphenyl)-8-pyrrolidin-1-ylimidazo[1,2-a]pyrazine?
The canonical SMILES for 3-(2,4-dimethoxyphenyl)-8-pyrrolidin-1-ylimidazo[1,2-a]pyrazine is COc1ccc(-c2cnc3c(N4CCCC4)nccn23)c(OC)c1.
What is the InChIKey of 3-(2,4-dimethoxyphenyl)-8-pyrrolidin-1-ylimidazo[1,2-a]pyrazine?
The InChIKey is NMZQGYQNYCPHAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4O2/c1-23-13-5-6-14(16(11-13)24-2)15-12-20-18-17(19-7-10-22(15)18)21-8-3-4-9-21/h5-7,10-12H,3-4,8-9H2,1-2H3.
What are the key properties of 3-(2,4-dimethoxyphenyl)-8-pyrrolidin-1-ylimidazo[1,2-a]pyrazine?
3-(2,4-dimethoxyphenyl)-8-pyrrolidin-1-ylimidazo[1,2-a]pyrazine has a molecular weight of 324.38 g/mol, XLogP of 3.01, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,4-dimethoxyphenyl)-8-pyrrolidin-1-ylimidazo[1,2-a]pyrazine is sourced from PubChem (CID 163312851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).