2,2-dimethyl-3-(2-methylphenyl)-1-phenylimidazo[4,5-b]pyrazine

C20H20N4 — CID 130317602

IUPAC2,2-dimethyl-3-(2-methylphenyl)-1-phenylimidazo[4,5-b]pyrazine
SMILESCc1ccccc1N1c2nccnc2N(c2ccccc2)C1(C)C
InChIInChI=1S/C20H20N4/c1-15-9-7-8-12-17(15)24-19-18(21-13-14-22-19)23(20(24,2)3)16-10-5-4-6-11-16/h4-14H,1-3H3
InChIKeyBHVFHXZNKUJIBR-UHFFFAOYSA-N
MW316.41 g/mol
LogP4.81
Rot. Bonds2

About 2,2-dimethyl-3-(2-methylphenyl)-1-phenylimidazo[4,5-b]pyrazine

2,2-dimethyl-3-(2-methylphenyl)-1-phenylimidazo[4,5-b]pyrazine (PubChem CID 130317602) has the molecular formula C20H20N4 and a molecular weight of 316.41 g/mol. Its IUPAC name is 2,2-dimethyl-3-(2-methylphenyl)-1-phenylimidazo[4,5-b]pyrazine.

Molecular Properties

Compound Name2,2-dimethyl-3-(2-methylphenyl)-1-phenylimidazo[4,5-b]pyrazine
PubChem CID130317602
Molecular FormulaC20H20N4
Molecular Weight316.41 g/mol
Exact Mass316.17
IUPAC Name2,2-dimethyl-3-(2-methylphenyl)-1-phenylimidazo[4,5-b]pyrazine
SMILESCc1ccccc1N1c2nccnc2N(c2ccccc2)C1(C)C
InChIInChI=1S/C20H20N4/c1-15-9-7-8-12-17(15)24-19-18(21-13-14-22-19)23(20(24,2)3)16-10-5-4-6-11-16/h4-14H,1-3H3
InChIKeyBHVFHXZNKUJIBR-UHFFFAOYSA-N
XLogP4.81
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.41
LogP ≤ 54.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-3-(2-methylphenyl)-1-phenylimidazo[4,5-b]pyrazine?
The IUPAC name of 2,2-dimethyl-3-(2-methylphenyl)-1-phenylimidazo[4,5-b]pyrazine (CID 130317602) is 2,2-dimethyl-3-(2-methylphenyl)-1-phenylimidazo[4,5-b]pyrazine.
What is the SMILES notation for 2,2-dimethyl-3-(2-methylphenyl)-1-phenylimidazo[4,5-b]pyrazine?
The canonical SMILES for 2,2-dimethyl-3-(2-methylphenyl)-1-phenylimidazo[4,5-b]pyrazine is Cc1ccccc1N1c2nccnc2N(c2ccccc2)C1(C)C.
What is the InChIKey of 2,2-dimethyl-3-(2-methylphenyl)-1-phenylimidazo[4,5-b]pyrazine?
The InChIKey is BHVFHXZNKUJIBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4/c1-15-9-7-8-12-17(15)24-19-18(21-13-14-22-19)23(20(24,2)3)16-10-5-4-6-11-16/h4-14H,1-3H3.
What are the key properties of 2,2-dimethyl-3-(2-methylphenyl)-1-phenylimidazo[4,5-b]pyrazine?
2,2-dimethyl-3-(2-methylphenyl)-1-phenylimidazo[4,5-b]pyrazine has a molecular weight of 316.41 g/mol, XLogP of 4.81, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-3-(2-methylphenyl)-1-phenylimidazo[4,5-b]pyrazine is sourced from PubChem (CID 130317602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).