2-(3-methyl-1,2-dihydroimidazol-2-yl)-1-phenyl-3-(2-prop-1-en-2-ylphenyl)-2H-imidazo[4,5-b]pyrazine

C24H24N6 — CID 138712592

IUPAC2-(3-methyl-1,2-dihydroimidazol-2-yl)-1-phenyl-3-(2-prop-1-en-2-ylphenyl)-2H-imidazo[4,5-b]pyrazine
SMILESC=C(C)c1ccccc1N1c2nccnc2N(c2ccccc2)C1C1NC=CN1C
InChIInChI=1S/C24H24N6/c1-17(2)19-11-7-8-12-20(19)30-22-21(25-13-14-26-22)29(18-9-5-4-6-10-18)24(30)23-27-15-16-28(23)3/h4-16,23-24,27H,1H2,2-3H3
InChIKeyBUOMONQBLODCRS-UHFFFAOYSA-N
MW396.50 g/mol
LogP4.46
Rot. Bonds4

About 2-(3-methyl-1,2-dihydroimidazol-2-yl)-1-phenyl-3-(2-prop-1-en-2-ylphenyl)-2H-imidazo[4,5-b]pyrazine

2-(3-methyl-1,2-dihydroimidazol-2-yl)-1-phenyl-3-(2-prop-1-en-2-ylphenyl)-2H-imidazo[4,5-b]pyrazine (PubChem CID 138712592) has the molecular formula C24H24N6 and a molecular weight of 396.50 g/mol. Its IUPAC name is 2-(3-methyl-1,2-dihydroimidazol-2-yl)-1-phenyl-3-(2-prop-1-en-2-ylphenyl)-2H-imidazo[4,5-b]pyrazine.

Molecular Properties

Compound Name2-(3-methyl-1,2-dihydroimidazol-2-yl)-1-phenyl-3-(2-prop-1-en-2-ylphenyl)-2H-imidazo[4,5-b]pyrazine
PubChem CID138712592
Molecular FormulaC24H24N6
Molecular Weight396.50 g/mol
Exact Mass396.21
IUPAC Name2-(3-methyl-1,2-dihydroimidazol-2-yl)-1-phenyl-3-(2-prop-1-en-2-ylphenyl)-2H-imidazo[4,5-b]pyrazine
SMILESC=C(C)c1ccccc1N1c2nccnc2N(c2ccccc2)C1C1NC=CN1C
InChIInChI=1S/C24H24N6/c1-17(2)19-11-7-8-12-20(19)30-22-21(25-13-14-26-22)29(18-9-5-4-6-10-18)24(30)23-27-15-16-28(23)3/h4-16,23-24,27H,1H2,2-3H3
InChIKeyBUOMONQBLODCRS-UHFFFAOYSA-N
XLogP4.46
TPSA47.53 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.50
LogP ≤ 54.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methyl-1,2-dihydroimidazol-2-yl)-1-phenyl-3-(2-prop-1-en-2-ylphenyl)-2H-imidazo[4,5-b]pyrazine?
The IUPAC name of 2-(3-methyl-1,2-dihydroimidazol-2-yl)-1-phenyl-3-(2-prop-1-en-2-ylphenyl)-2H-imidazo[4,5-b]pyrazine (CID 138712592) is 2-(3-methyl-1,2-dihydroimidazol-2-yl)-1-phenyl-3-(2-prop-1-en-2-ylphenyl)-2H-imidazo[4,5-b]pyrazine.
What is the SMILES notation for 2-(3-methyl-1,2-dihydroimidazol-2-yl)-1-phenyl-3-(2-prop-1-en-2-ylphenyl)-2H-imidazo[4,5-b]pyrazine?
The canonical SMILES for 2-(3-methyl-1,2-dihydroimidazol-2-yl)-1-phenyl-3-(2-prop-1-en-2-ylphenyl)-2H-imidazo[4,5-b]pyrazine is C=C(C)c1ccccc1N1c2nccnc2N(c2ccccc2)C1C1NC=CN1C.
What is the InChIKey of 2-(3-methyl-1,2-dihydroimidazol-2-yl)-1-phenyl-3-(2-prop-1-en-2-ylphenyl)-2H-imidazo[4,5-b]pyrazine?
The InChIKey is BUOMONQBLODCRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N6/c1-17(2)19-11-7-8-12-20(19)30-22-21(25-13-14-26-22)29(18-9-5-4-6-10-18)24(30)23-27-15-16-28(23)3/h4-16,23-24,27H,1H2,2-3H3.
What are the key properties of 2-(3-methyl-1,2-dihydroimidazol-2-yl)-1-phenyl-3-(2-prop-1-en-2-ylphenyl)-2H-imidazo[4,5-b]pyrazine?
2-(3-methyl-1,2-dihydroimidazol-2-yl)-1-phenyl-3-(2-prop-1-en-2-ylphenyl)-2H-imidazo[4,5-b]pyrazine has a molecular weight of 396.50 g/mol, XLogP of 4.46, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methyl-1,2-dihydroimidazol-2-yl)-1-phenyl-3-(2-prop-1-en-2-ylphenyl)-2H-imidazo[4,5-b]pyrazine is sourced from PubChem (CID 138712592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).