6-(1-benzylpyrazol-4-yl)-N-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine

C23H20N6O — CID 52946839

IUPAC6-(1-benzylpyrazol-4-yl)-N-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine
SMILESCOc1ccc(Nc2nc(-c3cnn(Cc4ccccc4)c3)cn3ccnc23)cc1
InChIInChI=1S/C23H20N6O/c1-30-20-9-7-19(8-10-20)26-22-23-24-11-12-28(23)16-21(27-22)18-13-25-29(15-18)14-17-5-3-2-4-6-17/h2-13,15-16H,14H2,1H3,(H,26,27)
InChIKeyIWYSKGJPOBMTBT-UHFFFAOYSA-N
MW396.45 g/mol
LogP4.39
Rot. Bonds6

About 6-(1-benzylpyrazol-4-yl)-N-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine

6-(1-benzylpyrazol-4-yl)-N-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine (PubChem CID 52946839) has the molecular formula C23H20N6O and a molecular weight of 396.45 g/mol. Its IUPAC name is 6-(1-benzylpyrazol-4-yl)-N-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound Name6-(1-benzylpyrazol-4-yl)-N-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine
PubChem CID52946839
Molecular FormulaC23H20N6O
Molecular Weight396.45 g/mol
Exact Mass396.17
IUPAC Name6-(1-benzylpyrazol-4-yl)-N-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine
SMILESCOc1ccc(Nc2nc(-c3cnn(Cc4ccccc4)c3)cn3ccnc23)cc1
InChIInChI=1S/C23H20N6O/c1-30-20-9-7-19(8-10-20)26-22-23-24-11-12-28(23)16-21(27-22)18-13-25-29(15-18)14-17-5-3-2-4-6-17/h2-13,15-16H,14H2,1H3,(H,26,27)
InChIKeyIWYSKGJPOBMTBT-UHFFFAOYSA-N
XLogP4.39
TPSA69.27 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.45
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-(1-benzylpyrazol-4-yl)-N-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of 6-(1-benzylpyrazol-4-yl)-N-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine (CID 52946839) is 6-(1-benzylpyrazol-4-yl)-N-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for 6-(1-benzylpyrazol-4-yl)-N-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for 6-(1-benzylpyrazol-4-yl)-N-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine is COc1ccc(Nc2nc(-c3cnn(Cc4ccccc4)c3)cn3ccnc23)cc1.
What is the InChIKey of 6-(1-benzylpyrazol-4-yl)-N-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine?
The InChIKey is IWYSKGJPOBMTBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N6O/c1-30-20-9-7-19(8-10-20)26-22-23-24-11-12-28(23)16-21(27-22)18-13-25-29(15-18)14-17-5-3-2-4-6-17/h2-13,15-16H,14H2,1H3,(H,26,27).
What are the key properties of 6-(1-benzylpyrazol-4-yl)-N-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine?
6-(1-benzylpyrazol-4-yl)-N-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine has a molecular weight of 396.45 g/mol, XLogP of 4.39, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-benzylpyrazol-4-yl)-N-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 52946839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).