(5-cyclopropyl-1,2-oxazol-3-yl)-[(5S)-5-[(dimethylamino)methyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone

C16H21N5O2 — CID 124820262

About (5-cyclopropyl-1,2-oxazol-3-yl)-[(5S)-5-[(dimethylamino)methyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone

(5-cyclopropyl-1,2-oxazol-3-yl)-[(5S)-5-[(dimethylamino)methyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone (PubChem CID 124820262) has the molecular formula C16H21N5O2 and a molecular weight of 315.38 g/mol. Its IUPAC name is (5-cyclopropyl-1,2-oxazol-3-yl)-[(5S)-5-[(dimethylamino)methyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone.

Molecular Properties

• Compound Name: (5-cyclopropyl-1,2-oxazol-3-yl)-[(5S)-5-[(dimethylamino)methyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone
• PubChem CID: 124820262
• Molecular Formula: C16H21N5O2
• Molecular Weight: 315.38 g/mol
• Exact Mass: 315.17
• IUPAC Name: (5-cyclopropyl-1,2-oxazol-3-yl)-[(5S)-5-[(dimethylamino)methyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone
• SMILES: CN(C)C[C@H]1CN(C(=O)c2cc(C3CC3)on2)Cc2cncn21
• InChI: InChI=1S/C16H21N5O2/c1-19(2)7-13-9-20(8-12-6-17-10-21(12)13)16(22)14-5-15(23-18-14)11-3-4-11/h5-6,10-11,13H,3-4,7-9H2,1-2H3/t13-/m0/s1
• InChIKey: WTYKVWBKKXMSBP-ZDUSSCGKSA-N
• XLogP: 1.51
• TPSA: 67.40 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 4
• Heavy Atoms: 23
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	315.38
LogP ≤ 5	1.51
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of (5-cyclopropyl-1,2-oxazol-3-yl)-[(5S)-5-[(dimethylamino)methyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone?

The IUPAC name of (5-cyclopropyl-1,2-oxazol-3-yl)-[(5S)-5-[(dimethylamino)methyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone (CID 124820262) is (5-cyclopropyl-1,2-oxazol-3-yl)-[(5S)-5-[(dimethylamino)methyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone.

What is the SMILES notation for (5-cyclopropyl-1,2-oxazol-3-yl)-[(5S)-5-[(dimethylamino)methyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone?

The canonical SMILES for (5-cyclopropyl-1,2-oxazol-3-yl)-[(5S)-5-[(dimethylamino)methyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone is CN(C)C[C@H]1CN(C(=O)c2cc(C3CC3)on2)Cc2cncn21.

What is the InChIKey of (5-cyclopropyl-1,2-oxazol-3-yl)-[(5S)-5-[(dimethylamino)methyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone?

The InChIKey is WTYKVWBKKXMSBP-ZDUSSCGKSA-N. The full InChI is InChI=1S/C16H21N5O2/c1-19(2)7-13-9-20(8-12-6-17-10-21(12)13)16(22)14-5-15(23-18-14)11-3-4-11/h5-6,10-11,13H,3-4,7-9H2,1-2H3/t13-/m0/s1.

What are the key properties of (5-cyclopropyl-1,2-oxazol-3-yl)-[(5S)-5-[(dimethylamino)methyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone?

(5-cyclopropyl-1,2-oxazol-3-yl)-[(5S)-5-[(dimethylamino)methyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone has a molecular weight of 315.38 g/mol, XLogP of 1.51, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for (5-cyclopropyl-1,2-oxazol-3-yl)-[(5S)-5-[(dimethylamino)methyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]methanone is sourced from PubChem (CID 124820262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).