3,4-dihydro-1H-isoquinolin-2-yl-[2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-yl]methanone

C24H24N2O2 — CID 56559589

About 3,4-dihydro-1H-isoquinolin-2-yl-[2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-yl]methanone

3,4-dihydro-1H-isoquinolin-2-yl-[2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-yl]methanone (PubChem CID 56559589) has the molecular formula C24H24N2O2 and a molecular weight of 372.47 g/mol. Its IUPAC name is 3,4-dihydro-1H-isoquinolin-2-yl-[2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-yl]methanone.

Molecular Properties

• Compound Name: 3,4-dihydro-1H-isoquinolin-2-yl-[2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-yl]methanone
• PubChem CID: 56559589
• Molecular Formula: C24H24N2O2
• Molecular Weight: 372.47 g/mol
• Exact Mass: 372.18
• IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-[2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-yl]methanone
• SMILES: CC1Cc2ccccc2N1Cc1occc1C(=O)N1CCc2ccccc2C1
• InChI: InChI=1S/C24H24N2O2/c1-17-14-19-7-4-5-9-22(19)26(17)16-23-21(11-13-28-23)24(27)25-12-10-18-6-2-3-8-20(18)15-25/h2-9,11,13,17H,10,12,14-16H2,1H3
• InChIKey: VWWKXPDZKKNDBM-UHFFFAOYSA-N
• XLogP: 4.43
• TPSA: 36.69 Ų
• H-Bond Acceptors: 3
• Rotatable Bonds: 3
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	372.47
LogP ≤ 5	4.43
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of 3,4-dihydro-1H-isoquinolin-2-yl-[2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-yl]methanone?

The IUPAC name of 3,4-dihydro-1H-isoquinolin-2-yl-[2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-yl]methanone (CID 56559589) is 3,4-dihydro-1H-isoquinolin-2-yl-[2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-yl]methanone.

What is the SMILES notation for 3,4-dihydro-1H-isoquinolin-2-yl-[2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-yl]methanone?

The canonical SMILES for 3,4-dihydro-1H-isoquinolin-2-yl-[2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-yl]methanone is CC1Cc2ccccc2N1Cc1occc1C(=O)N1CCc2ccccc2C1.

What is the InChIKey of 3,4-dihydro-1H-isoquinolin-2-yl-[2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-yl]methanone?

The InChIKey is VWWKXPDZKKNDBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O2/c1-17-14-19-7-4-5-9-22(19)26(17)16-23-21(11-13-28-23)24(27)25-12-10-18-6-2-3-8-20(18)15-25/h2-9,11,13,17H,10,12,14-16H2,1H3.

What are the key properties of 3,4-dihydro-1H-isoquinolin-2-yl-[2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-yl]methanone?

3,4-dihydro-1H-isoquinolin-2-yl-[2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-yl]methanone has a molecular weight of 372.47 g/mol, XLogP of 4.43, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for 3,4-dihydro-1H-isoquinolin-2-yl-[2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-yl]methanone is sourced from PubChem (CID 56559589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).