[2-methyl-2-[1-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)isoquinolin-3-yl]propyl]-(pyridin-2-ylmethyl)azanide;platinum(2+)

C30H33N5Pt — CID 153419214

About [2-methyl-2-[1-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)isoquinolin-3-yl]propyl]-(pyridin-2-ylmethyl)azanide;platinum(2+)

[2-methyl-2-[1-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)isoquinolin-3-yl]propyl]-(pyridin-2-ylmethyl)azanide;platinum(2+) (PubChem CID 153419214) has the molecular formula C30H33N5Pt and a molecular weight of 658.71 g/mol. Its IUPAC name is [2-methyl-2-[1-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)isoquinolin-3-yl]propyl]-(pyridin-2-ylmethyl)azanide;platinum(2+).

Molecular Properties

• Compound Name: [2-methyl-2-[1-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)isoquinolin-3-yl]propyl]-(pyridin-2-ylmethyl)azanide;platinum(2+)
• PubChem CID: 153419214
• Molecular Formula: C30H33N5Pt
• Molecular Weight: 658.71 g/mol
• Exact Mass: 658.24
• IUPAC Name: [2-methyl-2-[1-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)isoquinolin-3-yl]propyl]-(pyridin-2-ylmethyl)azanide;platinum(2+)
• SMILES: CC(C)(C[N-]Cc1ccccn1)c1cc2ccccc2c(-c2[n-]nc3c2C2CCC3(C)C2(C)C)n1.[Pt+2]
• InChI: InChI=1S/C30H33N5.Pt/c1-28(2,18-31-17-20-11-8-9-15-32-20)23-16-19-10-6-7-12-21(19)25(33-23)26-24-22-13-14-30(5,29(22,3)4)27(24)35-34-26;/h6-12,15-16,22H,13-14,17-18H2,1-5H3;/q-2;+2
• InChIKey: CZMZQRMCFUAPGV-UHFFFAOYSA-N
• XLogP: 6.67
• TPSA: 66.87 Ų
• H-Bond Acceptors: 3
• Rotatable Bonds: 6
• Heavy Atoms: 36
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	658.71
LogP ≤ 5	6.67
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of [2-methyl-2-[1-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)isoquinolin-3-yl]propyl]-(pyridin-2-ylmethyl)azanide;platinum(2+)?

The IUPAC name of [2-methyl-2-[1-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)isoquinolin-3-yl]propyl]-(pyridin-2-ylmethyl)azanide;platinum(2+) (CID 153419214) is [2-methyl-2-[1-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)isoquinolin-3-yl]propyl]-(pyridin-2-ylmethyl)azanide;platinum(2+).

What is the SMILES notation for [2-methyl-2-[1-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)isoquinolin-3-yl]propyl]-(pyridin-2-ylmethyl)azanide;platinum(2+)?

The canonical SMILES for [2-methyl-2-[1-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)isoquinolin-3-yl]propyl]-(pyridin-2-ylmethyl)azanide;platinum(2+) is CC(C)(C[N-]Cc1ccccn1)c1cc2ccccc2c(-c2[n-]nc3c2C2CCC3(C)C2(C)C)n1.[Pt+2].

What is the InChIKey of [2-methyl-2-[1-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)isoquinolin-3-yl]propyl]-(pyridin-2-ylmethyl)azanide;platinum(2+)?

The InChIKey is CZMZQRMCFUAPGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H33N5.Pt/c1-28(2,18-31-17-20-11-8-9-15-32-20)23-16-19-10-6-7-12-21(19)25(33-23)26-24-22-13-14-30(5,29(22,3)4)27(24)35-34-26;/h6-12,15-16,22H,13-14,17-18H2,1-5H3;/q-2;+2.

What are the key properties of [2-methyl-2-[1-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)isoquinolin-3-yl]propyl]-(pyridin-2-ylmethyl)azanide;platinum(2+)?

[2-methyl-2-[1-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)isoquinolin-3-yl]propyl]-(pyridin-2-ylmethyl)azanide;platinum(2+) has a molecular weight of 658.71 g/mol, XLogP of 6.67, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for [2-methyl-2-[1-(1,10,10-trimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-dien-5-yl)isoquinolin-3-yl]propyl]-(pyridin-2-ylmethyl)azanide;platinum(2+) is sourced from PubChem (CID 153419214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).