3-cyclopropyl-1-[3-(3,6-dihydro-2H-pyran-4-yl)isoquinolin-8-yl]-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-cyclopropyl-5,7-dimethyl-1-[3-(oxan-4-yl)isoquinolin-8-yl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-cyclopropyl-1-imidazo[1,5-a]pyridin-7-yl-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;bis(3-cyclopropyl-1-[3-isocyano-2-(1-methylpyrazol-4-yl)quinolin-5-yl]-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one)

C118H119N27O7 — CID 157298762

About 3-cyclopropyl-1-[3-(3,6-dihydro-2H-pyran-4-yl)isoquinolin-8-yl]-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-cyclopropyl-5,7-dimethyl-1-[3-(oxan-4-yl)isoquinolin-8-yl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-cyclopropyl-1-imidazo[1,5-a]pyridin-7-yl-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;bis(3-cyclopropyl-1-[3-isocyano-2-(1-methylpyrazol-4-yl)quinolin-5-yl]-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one)

3-cyclopropyl-1-[3-(3,6-dihydro-2H-pyran-4-yl)isoquinolin-8-yl]-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-cyclopropyl-5,7-dimethyl-1-[3-(oxan-4-yl)isoquinolin-8-yl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-cyclopropyl-1-imidazo[1,5-a]pyridin-7-yl-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;bis(3-cyclopropyl-1-[3-isocyano-2-(1-methylpyrazol-4-yl)quinolin-5-yl]-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one) (PubChem CID 157298762) has the molecular formula C118H119N27O7 and a molecular weight of 2027.43 g/mol. Its IUPAC name is 3-cyclopropyl-1-[3-(3,6-dihydro-2H-pyran-4-yl)isoquinolin-8-yl]-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-cyclopropyl-5,7-dimethyl-1-[3-(oxan-4-yl)isoquinolin-8-yl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-cyclopropyl-1-imidazo[1,5-a]pyridin-7-yl-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;bis(3-cyclopropyl-1-[3-isocyano-2-(1-methylpyrazol-4-yl)quinolin-5-yl]-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one).

Molecular Properties

• Compound Name: 3-cyclopropyl-1-[3-(3,6-dihydro-2H-pyran-4-yl)isoquinolin-8-yl]-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-cyclopropyl-5,7-dimethyl-1-[3-(oxan-4-yl)isoquinolin-8-yl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-cyclopropyl-1-imidazo[1,5-a]pyridin-7-yl-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;bis(3-cyclopropyl-1-[3-isocyano-2-(1-methylpyrazol-4-yl)quinolin-5-yl]-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one)
• PubChem CID: 157298762
• Molecular Formula: C118H119N27O7
• Molecular Weight: 2027.43 g/mol
• Exact Mass: 2025.98
• IUPAC Name: 3-cyclopropyl-1-[3-(3,6-dihydro-2H-pyran-4-yl)isoquinolin-8-yl]-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-cyclopropyl-5,7-dimethyl-1-[3-(oxan-4-yl)isoquinolin-8-yl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-cyclopropyl-1-imidazo[1,5-a]pyridin-7-yl-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;bis(3-cyclopropyl-1-[3-isocyano-2-(1-methylpyrazol-4-yl)quinolin-5-yl]-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one)
• SMILES: CC1C(=O)N(C)Cc2c(-c3cccc4cc(C5=CCOCC5)ncc34)nc(C3CC3)n21.CC1C(=O)N(C)Cc2c(-c3cccc4cc(C5CCOCC5)ncc34)nc(C3CC3)n21.CC1C(=O)N(C)Cc2c(-c3ccn4cncc4c3)nc(C3CC3)n21.[C-]#[N+]c1cc2c(-c3nc(C4CC4)n4c3CN(C)C(=O)C4C)cccc2nc1-c1cnn(C)c1.[C-]#[N+]c1cc2c(-c3nc(C4CC4)n4c3CN(C)C(=O)C4C)cccc2nc1-c1cnn(C)c1
• InChI: InChI=1S/2C25H23N7O.C25H28N4O2.C25H26N4O2.C18H19N5O/c2*1-14-25(33)30(3)13-21-23(29-24(32(14)21)15-8-9-15)17-6-5-7-19-18(17)10-20(26-2)22(28-19)16-11-27-31(4)12-16;2*1-15-25(30)28(2)14-22-23(27-24(29(15)22)17-6-7-17)19-5-3-4-18-12-21(26-13-20(18)19)16-8-10-31-11-9-16;1-11-18(24)21(2)9-15-16(20-17(23(11)15)12-3-4-12)13-5-6-22-10-19-8-14(22)7-13/h2*5-7,10-12,14-15H,8-9,13H2,1,3-4H3;3-5,12-13,15-17H,6-11,14H2,1-2H3;3-5,8,12-13,15,17H,6-7,9-11,14H2,1-2H3;5-8,10-12H,3-4,9H2,1-2H3
• InChIKey: BBQMXCJTRBSBMT-UHFFFAOYSA-N
• XLogP: 20.24
• TPSA: 322.33 Ų
• H-Bond Acceptors: 27
• Rotatable Bonds: 14
• Heavy Atoms: 152
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2027.43
LogP ≤ 5	20.24
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	27

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-1-[3-(3,6-dihydro-2H-pyran-4-yl)isoquinolin-8-yl]-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-cyclopropyl-5,7-dimethyl-1-[3-(oxan-4-yl)isoquinolin-8-yl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-cyclopropyl-1-imidazo[1,5-a]pyridin-7-yl-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;bis(3-cyclopropyl-1-[3-isocyano-2-(1-methylpyrazol-4-yl)quinolin-5-yl]-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one)?

The IUPAC name of 3-cyclopropyl-1-[3-(3,6-dihydro-2H-pyran-4-yl)isoquinolin-8-yl]-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-cyclopropyl-5,7-dimethyl-1-[3-(oxan-4-yl)isoquinolin-8-yl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-cyclopropyl-1-imidazo[1,5-a]pyridin-7-yl-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;bis(3-cyclopropyl-1-[3-isocyano-2-(1-methylpyrazol-4-yl)quinolin-5-yl]-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one) (CID 157298762) is 3-cyclopropyl-1-[3-(3,6-dihydro-2H-pyran-4-yl)isoquinolin-8-yl]-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-cyclopropyl-5,7-dimethyl-1-[3-(oxan-4-yl)isoquinolin-8-yl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-cyclopropyl-1-imidazo[1,5-a]pyridin-7-yl-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;bis(3-cyclopropyl-1-[3-isocyano-2-(1-methylpyrazol-4-yl)quinolin-5-yl]-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one).

What is the SMILES notation for 3-cyclopropyl-1-[3-(3,6-dihydro-2H-pyran-4-yl)isoquinolin-8-yl]-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-cyclopropyl-5,7-dimethyl-1-[3-(oxan-4-yl)isoquinolin-8-yl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-cyclopropyl-1-imidazo[1,5-a]pyridin-7-yl-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;bis(3-cyclopropyl-1-[3-isocyano-2-(1-methylpyrazol-4-yl)quinolin-5-yl]-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one)?

The canonical SMILES for 3-cyclopropyl-1-[3-(3,6-dihydro-2H-pyran-4-yl)isoquinolin-8-yl]-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-cyclopropyl-5,7-dimethyl-1-[3-(oxan-4-yl)isoquinolin-8-yl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-cyclopropyl-1-imidazo[1,5-a]pyridin-7-yl-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;bis(3-cyclopropyl-1-[3-isocyano-2-(1-methylpyrazol-4-yl)quinolin-5-yl]-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one) is CC1C(=O)N(C)Cc2c(-c3cccc4cc(C5=CCOCC5)ncc34)nc(C3CC3)n21.CC1C(=O)N(C)Cc2c(-c3cccc4cc(C5CCOCC5)ncc34)nc(C3CC3)n21.CC1C(=O)N(C)Cc2c(-c3ccn4cncc4c3)nc(C3CC3)n21.[C-]#[N+]c1cc2c(-c3nc(C4CC4)n4c3CN(C)C(=O)C4C)cccc2nc1-c1cnn(C)c1.[C-]#[N+]c1cc2c(-c3nc(C4CC4)n4c3CN(C)C(=O)C4C)cccc2nc1-c1cnn(C)c1.

What is the InChIKey of 3-cyclopropyl-1-[3-(3,6-dihydro-2H-pyran-4-yl)isoquinolin-8-yl]-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-cyclopropyl-5,7-dimethyl-1-[3-(oxan-4-yl)isoquinolin-8-yl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-cyclopropyl-1-imidazo[1,5-a]pyridin-7-yl-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;bis(3-cyclopropyl-1-[3-isocyano-2-(1-methylpyrazol-4-yl)quinolin-5-yl]-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one)?

The InChIKey is BBQMXCJTRBSBMT-UHFFFAOYSA-N. The full InChI is InChI=1S/2C25H23N7O.C25H28N4O2.C25H26N4O2.C18H19N5O/c2*1-14-25(33)30(3)13-21-23(29-24(32(14)21)15-8-9-15)17-6-5-7-19-18(17)10-20(26-2)22(28-19)16-11-27-31(4)12-16;2*1-15-25(30)28(2)14-22-23(27-24(29(15)22)17-6-7-17)19-5-3-4-18-12-21(26-13-20(18)19)16-8-10-31-11-9-16;1-11-18(24)21(2)9-15-16(20-17(23(11)15)12-3-4-12)13-5-6-22-10-19-8-14(22)7-13/h2*5-7,10-12,14-15H,8-9,13H2,1,3-4H3;3-5,12-13,15-17H,6-11,14H2,1-2H3;3-5,8,12-13,15,17H,6-7,9-11,14H2,1-2H3;5-8,10-12H,3-4,9H2,1-2H3.

What are the key properties of 3-cyclopropyl-1-[3-(3,6-dihydro-2H-pyran-4-yl)isoquinolin-8-yl]-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-cyclopropyl-5,7-dimethyl-1-[3-(oxan-4-yl)isoquinolin-8-yl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-cyclopropyl-1-imidazo[1,5-a]pyridin-7-yl-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;bis(3-cyclopropyl-1-[3-isocyano-2-(1-methylpyrazol-4-yl)quinolin-5-yl]-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one)?

3-cyclopropyl-1-[3-(3,6-dihydro-2H-pyran-4-yl)isoquinolin-8-yl]-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-cyclopropyl-5,7-dimethyl-1-[3-(oxan-4-yl)isoquinolin-8-yl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-cyclopropyl-1-imidazo[1,5-a]pyridin-7-yl-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;bis(3-cyclopropyl-1-[3-isocyano-2-(1-methylpyrazol-4-yl)quinolin-5-yl]-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one) has a molecular weight of 2027.43 g/mol, XLogP of 20.24, 14 rotatable bonds, 0 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for 3-cyclopropyl-1-[3-(3,6-dihydro-2H-pyran-4-yl)isoquinolin-8-yl]-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-cyclopropyl-5,7-dimethyl-1-[3-(oxan-4-yl)isoquinolin-8-yl]-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;3-cyclopropyl-1-imidazo[1,5-a]pyridin-7-yl-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one;bis(3-cyclopropyl-1-[3-isocyano-2-(1-methylpyrazol-4-yl)quinolin-5-yl]-5,7-dimethyl-5,8-dihydroimidazo[1,5-a]pyrazin-6-one) is sourced from PubChem (CID 157298762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).