(3,3-dimethylmorpholin-4-yl)-[7-methoxy-8-propan-2-yloxy-1-(2-propylpyrazol-3-yl)-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone

C28H37N5O4 — CID 87057514

About (3,3-dimethylmorpholin-4-yl)-[7-methoxy-8-propan-2-yloxy-1-(2-propylpyrazol-3-yl)-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone

(3,3-dimethylmorpholin-4-yl)-[7-methoxy-8-propan-2-yloxy-1-(2-propylpyrazol-3-yl)-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone (PubChem CID 87057514) has the molecular formula C28H37N5O4 and a molecular weight of 507.64 g/mol. Its IUPAC name is (3,3-dimethylmorpholin-4-yl)-[7-methoxy-8-propan-2-yloxy-1-(2-propylpyrazol-3-yl)-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone.

Molecular Properties

• Compound Name: (3,3-dimethylmorpholin-4-yl)-[7-methoxy-8-propan-2-yloxy-1-(2-propylpyrazol-3-yl)-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone
• PubChem CID: 87057514
• Molecular Formula: C28H37N5O4
• Molecular Weight: 507.64 g/mol
• Exact Mass: 507.28
• IUPAC Name: (3,3-dimethylmorpholin-4-yl)-[7-methoxy-8-propan-2-yloxy-1-(2-propylpyrazol-3-yl)-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone
• SMILES: CCCn1nccc1-c1nc(C(=O)N2CCOCC2(C)C)c2n1-c1cc(OC(C)C)c(OC)cc1CC2
• InChI: InChI=1S/C28H37N5O4/c1-7-12-32-21(10-11-29-32)26-30-25(27(34)31-13-14-36-17-28(31,4)5)20-9-8-19-15-23(35-6)24(37-18(2)3)16-22(19)33(20)26/h10-11,15-16,18H,7-9,12-14,17H2,1-6H3
• InChIKey: GLDUMODMINYCBT-UHFFFAOYSA-N
• XLogP: 4.29
• TPSA: 83.64 Ų
• H-Bond Acceptors: 8
• Rotatable Bonds: 7
• Heavy Atoms: 37
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	507.64
LogP ≤ 5	4.29
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of (3,3-dimethylmorpholin-4-yl)-[7-methoxy-8-propan-2-yloxy-1-(2-propylpyrazol-3-yl)-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone?

The IUPAC name of (3,3-dimethylmorpholin-4-yl)-[7-methoxy-8-propan-2-yloxy-1-(2-propylpyrazol-3-yl)-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone (CID 87057514) is (3,3-dimethylmorpholin-4-yl)-[7-methoxy-8-propan-2-yloxy-1-(2-propylpyrazol-3-yl)-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone.

What is the SMILES notation for (3,3-dimethylmorpholin-4-yl)-[7-methoxy-8-propan-2-yloxy-1-(2-propylpyrazol-3-yl)-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone?

The canonical SMILES for (3,3-dimethylmorpholin-4-yl)-[7-methoxy-8-propan-2-yloxy-1-(2-propylpyrazol-3-yl)-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone is CCCn1nccc1-c1nc(C(=O)N2CCOCC2(C)C)c2n1-c1cc(OC(C)C)c(OC)cc1CC2.

What is the InChIKey of (3,3-dimethylmorpholin-4-yl)-[7-methoxy-8-propan-2-yloxy-1-(2-propylpyrazol-3-yl)-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone?

The InChIKey is GLDUMODMINYCBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H37N5O4/c1-7-12-32-21(10-11-29-32)26-30-25(27(34)31-13-14-36-17-28(31,4)5)20-9-8-19-15-23(35-6)24(37-18(2)3)16-22(19)33(20)26/h10-11,15-16,18H,7-9,12-14,17H2,1-6H3.

What are the key properties of (3,3-dimethylmorpholin-4-yl)-[7-methoxy-8-propan-2-yloxy-1-(2-propylpyrazol-3-yl)-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone?

(3,3-dimethylmorpholin-4-yl)-[7-methoxy-8-propan-2-yloxy-1-(2-propylpyrazol-3-yl)-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone has a molecular weight of 507.64 g/mol, XLogP of 4.29, 7 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for (3,3-dimethylmorpholin-4-yl)-[7-methoxy-8-propan-2-yloxy-1-(2-propylpyrazol-3-yl)-4,5-dihydroimidazo[1,5-a]quinolin-3-yl]methanone is sourced from PubChem (CID 87057514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).