1,3-bis(4-methylphenyl)-2H-imidazo[4,5-b]pyrazine

C19H18N4 — CID 140758501

IUPAC1,3-bis(4-methylphenyl)-2H-imidazo[4,5-b]pyrazine
SMILESCc1ccc(N2CN(c3ccc(C)cc3)c3nccnc32)cc1
InChIInChI=1S/C19H18N4/c1-14-3-7-16(8-4-14)22-13-23(17-9-5-15(2)6-10-17)19-18(22)20-11-12-21-19/h3-12H,13H2,1-2H3
InChIKeyQFJRXXOGIWLJHH-UHFFFAOYSA-N
MW302.38 g/mol
LogP4.34
Rot. Bonds2

About 1,3-bis(4-methylphenyl)-2H-imidazo[4,5-b]pyrazine

1,3-bis(4-methylphenyl)-2H-imidazo[4,5-b]pyrazine (PubChem CID 140758501) has the molecular formula C19H18N4 and a molecular weight of 302.38 g/mol. Its IUPAC name is 1,3-bis(4-methylphenyl)-2H-imidazo[4,5-b]pyrazine.

Molecular Properties

Compound Name1,3-bis(4-methylphenyl)-2H-imidazo[4,5-b]pyrazine
PubChem CID140758501
Molecular FormulaC19H18N4
Molecular Weight302.38 g/mol
Exact Mass302.15
IUPAC Name1,3-bis(4-methylphenyl)-2H-imidazo[4,5-b]pyrazine
SMILESCc1ccc(N2CN(c3ccc(C)cc3)c3nccnc32)cc1
InChIInChI=1S/C19H18N4/c1-14-3-7-16(8-4-14)22-13-23(17-9-5-15(2)6-10-17)19-18(22)20-11-12-21-19/h3-12H,13H2,1-2H3
InChIKeyQFJRXXOGIWLJHH-UHFFFAOYSA-N
XLogP4.34
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.38
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1,3-bis(4-methylphenyl)-2H-imidazo[4,5-b]pyrazine?
The IUPAC name of 1,3-bis(4-methylphenyl)-2H-imidazo[4,5-b]pyrazine (CID 140758501) is 1,3-bis(4-methylphenyl)-2H-imidazo[4,5-b]pyrazine.
What is the SMILES notation for 1,3-bis(4-methylphenyl)-2H-imidazo[4,5-b]pyrazine?
The canonical SMILES for 1,3-bis(4-methylphenyl)-2H-imidazo[4,5-b]pyrazine is Cc1ccc(N2CN(c3ccc(C)cc3)c3nccnc32)cc1.
What is the InChIKey of 1,3-bis(4-methylphenyl)-2H-imidazo[4,5-b]pyrazine?
The InChIKey is QFJRXXOGIWLJHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4/c1-14-3-7-16(8-4-14)22-13-23(17-9-5-15(2)6-10-17)19-18(22)20-11-12-21-19/h3-12H,13H2,1-2H3.
What are the key properties of 1,3-bis(4-methylphenyl)-2H-imidazo[4,5-b]pyrazine?
1,3-bis(4-methylphenyl)-2H-imidazo[4,5-b]pyrazine has a molecular weight of 302.38 g/mol, XLogP of 4.34, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-bis(4-methylphenyl)-2H-imidazo[4,5-b]pyrazine is sourced from PubChem (CID 140758501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).