3-(3-methoxy-1,2-oxazol-5-yl)-1-[(6S)-6-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]propan-1-one

C19H20N4O3 — CID 125015168

About 3-(3-methoxy-1,2-oxazol-5-yl)-1-[(6S)-6-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]propan-1-one

3-(3-methoxy-1,2-oxazol-5-yl)-1-[(6S)-6-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]propan-1-one (PubChem CID 125015168) has the molecular formula C19H20N4O3 and a molecular weight of 352.39 g/mol. Its IUPAC name is 3-(3-methoxy-1,2-oxazol-5-yl)-1-[(6S)-6-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]propan-1-one.

Molecular Properties

• Compound Name: 3-(3-methoxy-1,2-oxazol-5-yl)-1-[(6S)-6-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]propan-1-one
• PubChem CID: 125015168
• Molecular Formula: C19H20N4O3
• Molecular Weight: 352.39 g/mol
• Exact Mass: 352.15
• IUPAC Name: 3-(3-methoxy-1,2-oxazol-5-yl)-1-[(6S)-6-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]propan-1-one
• SMILES: COc1cc(CCC(=O)N2Cc3nccn3C[C@@H]2c2ccccc2)on1
• InChI: InChI=1S/C19H20N4O3/c1-25-18-11-15(26-21-18)7-8-19(24)23-13-17-20-9-10-22(17)12-16(23)14-5-3-2-4-6-14/h2-6,9-11,16H,7-8,12-13H2,1H3/t16-/m1/s1
• InChIKey: WROZZKHSUTVLPX-MRXNPFEDSA-N
• XLogP: 2.60
• TPSA: 73.39 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 5
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	352.39
LogP ≤ 5	2.60
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 3-(3-methoxy-1,2-oxazol-5-yl)-1-[(6S)-6-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]propan-1-one?

The IUPAC name of 3-(3-methoxy-1,2-oxazol-5-yl)-1-[(6S)-6-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]propan-1-one (CID 125015168) is 3-(3-methoxy-1,2-oxazol-5-yl)-1-[(6S)-6-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]propan-1-one.

What is the SMILES notation for 3-(3-methoxy-1,2-oxazol-5-yl)-1-[(6S)-6-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]propan-1-one?

The canonical SMILES for 3-(3-methoxy-1,2-oxazol-5-yl)-1-[(6S)-6-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]propan-1-one is COc1cc(CCC(=O)N2Cc3nccn3C[C@@H]2c2ccccc2)on1.

What is the InChIKey of 3-(3-methoxy-1,2-oxazol-5-yl)-1-[(6S)-6-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]propan-1-one?

The InChIKey is WROZZKHSUTVLPX-MRXNPFEDSA-N. The full InChI is InChI=1S/C19H20N4O3/c1-25-18-11-15(26-21-18)7-8-19(24)23-13-17-20-9-10-22(17)12-16(23)14-5-3-2-4-6-14/h2-6,9-11,16H,7-8,12-13H2,1H3/t16-/m1/s1.

What are the key properties of 3-(3-methoxy-1,2-oxazol-5-yl)-1-[(6S)-6-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]propan-1-one?

3-(3-methoxy-1,2-oxazol-5-yl)-1-[(6S)-6-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]propan-1-one has a molecular weight of 352.39 g/mol, XLogP of 2.60, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 3-(3-methoxy-1,2-oxazol-5-yl)-1-[(6S)-6-phenyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]propan-1-one is sourced from PubChem (CID 125015168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).