2,3-ditert-butyl-8-phenylimidazo[1,2-a]pyrazine

C20H25N3 — CID 155636927

IUPAC2,3-ditert-butyl-8-phenylimidazo[1,2-a]pyrazine
SMILESCC(C)(C)c1nc2c(-c3ccccc3)nccn2c1C(C)(C)C
InChIInChI=1S/C20H25N3/c1-19(2,3)16-17(20(4,5)6)23-13-12-21-15(18(23)22-16)14-10-8-7-9-11-14/h7-13H,1-6H3
InChIKeyJZKMQMXWEVSEBO-UHFFFAOYSA-N
MW307.44 g/mol
LogP4.99
Rot. Bonds1

About 2,3-ditert-butyl-8-phenylimidazo[1,2-a]pyrazine

2,3-ditert-butyl-8-phenylimidazo[1,2-a]pyrazine (PubChem CID 155636927) has the molecular formula C20H25N3 and a molecular weight of 307.44 g/mol. Its IUPAC name is 2,3-ditert-butyl-8-phenylimidazo[1,2-a]pyrazine.

Molecular Properties

Compound Name2,3-ditert-butyl-8-phenylimidazo[1,2-a]pyrazine
PubChem CID155636927
Molecular FormulaC20H25N3
Molecular Weight307.44 g/mol
Exact Mass307.20
IUPAC Name2,3-ditert-butyl-8-phenylimidazo[1,2-a]pyrazine
SMILESCC(C)(C)c1nc2c(-c3ccccc3)nccn2c1C(C)(C)C
InChIInChI=1S/C20H25N3/c1-19(2,3)16-17(20(4,5)6)23-13-12-21-15(18(23)22-16)14-10-8-7-9-11-14/h7-13H,1-6H3
InChIKeyJZKMQMXWEVSEBO-UHFFFAOYSA-N
XLogP4.99
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.44
LogP ≤ 54.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,3-ditert-butyl-8-phenylimidazo[1,2-a]pyrazine?
The IUPAC name of 2,3-ditert-butyl-8-phenylimidazo[1,2-a]pyrazine (CID 155636927) is 2,3-ditert-butyl-8-phenylimidazo[1,2-a]pyrazine.
What is the SMILES notation for 2,3-ditert-butyl-8-phenylimidazo[1,2-a]pyrazine?
The canonical SMILES for 2,3-ditert-butyl-8-phenylimidazo[1,2-a]pyrazine is CC(C)(C)c1nc2c(-c3ccccc3)nccn2c1C(C)(C)C.
What is the InChIKey of 2,3-ditert-butyl-8-phenylimidazo[1,2-a]pyrazine?
The InChIKey is JZKMQMXWEVSEBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3/c1-19(2,3)16-17(20(4,5)6)23-13-12-21-15(18(23)22-16)14-10-8-7-9-11-14/h7-13H,1-6H3.
What are the key properties of 2,3-ditert-butyl-8-phenylimidazo[1,2-a]pyrazine?
2,3-ditert-butyl-8-phenylimidazo[1,2-a]pyrazine has a molecular weight of 307.44 g/mol, XLogP of 4.99, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-ditert-butyl-8-phenylimidazo[1,2-a]pyrazine is sourced from PubChem (CID 155636927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).