1-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]piperidin-2-one;hydrochloride

C12H16ClF3N4O — CID 141185815

About 1-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]piperidin-2-one;hydrochloride

1-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]piperidin-2-one;hydrochloride (PubChem CID 141185815) has the molecular formula C12H16ClF3N4O and a molecular weight of 324.73 g/mol. Its IUPAC name is 1-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]piperidin-2-one;hydrochloride.

Molecular Properties

• Compound Name: 1-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]piperidin-2-one;hydrochloride
• PubChem CID: 141185815
• Molecular Formula: C12H16ClF3N4O
• Molecular Weight: 324.73 g/mol
• Exact Mass: 324.10
• IUPAC Name: 1-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]piperidin-2-one;hydrochloride
• SMILES: Cl.O=C1CCCCN1c1nc(C(F)(F)F)n2c1CNCC2
• InChI: InChI=1S/C12H15F3N4O.ClH/c13-12(14,15)11-17-10(8-7-16-4-6-18(8)11)19-5-2-1-3-9(19)20;/h16H,1-7H2;1H
• InChIKey: UBWDAWMTQNAGJP-UHFFFAOYSA-N
• XLogP: 1.94
• TPSA: 50.16 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 1
• Heavy Atoms: 21
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	324.73
LogP ≤ 5	1.94
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of 1-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]piperidin-2-one;hydrochloride?

The IUPAC name of 1-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]piperidin-2-one;hydrochloride (CID 141185815) is 1-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]piperidin-2-one;hydrochloride.

What is the SMILES notation for 1-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]piperidin-2-one;hydrochloride?

The canonical SMILES for 1-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]piperidin-2-one;hydrochloride is Cl.O=C1CCCCN1c1nc(C(F)(F)F)n2c1CNCC2.

What is the InChIKey of 1-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]piperidin-2-one;hydrochloride?

The InChIKey is UBWDAWMTQNAGJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15F3N4O.ClH/c13-12(14,15)11-17-10(8-7-16-4-6-18(8)11)19-5-2-1-3-9(19)20;/h16H,1-7H2;1H.

What are the key properties of 1-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]piperidin-2-one;hydrochloride?

1-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]piperidin-2-one;hydrochloride has a molecular weight of 324.73 g/mol, XLogP of 1.94, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]piperidin-2-one;hydrochloride is sourced from PubChem (CID 141185815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).