2-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4,5-dihydro-1H-purin-6-one;6-(6-piperidin-1-id-2-ylpiperidin-1-id-2-yl)-2H-pyridin-1-ide;platinum(2+)

C25H37N8O5Pt- — CID 5246729

About 2-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4,5-dihydro-1H-purin-6-one;6-(6-piperidin-1-id-2-ylpiperidin-1-id-2-yl)-2H-pyridin-1-ide;platinum(2+)

2-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4,5-dihydro-1H-purin-6-one;6-(6-piperidin-1-id-2-ylpiperidin-1-id-2-yl)-2H-pyridin-1-ide;platinum(2+) (PubChem CID 5246729) has the molecular formula C25H37N8O5Pt- and a molecular weight of 724.70 g/mol. Its IUPAC name is 2-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4,5-dihydro-1H-purin-6-one;6-(6-piperidin-1-id-2-ylpiperidin-1-id-2-yl)-2H-pyridin-1-ide;platinum(2+).

Molecular Properties

• Compound Name: 2-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4,5-dihydro-1H-purin-6-one;6-(6-piperidin-1-id-2-ylpiperidin-1-id-2-yl)-2H-pyridin-1-ide;platinum(2+)
• PubChem CID: 5246729
• Molecular Formula: C25H37N8O5Pt-
• Molecular Weight: 724.70 g/mol
• Exact Mass: 724.25
• IUPAC Name: 2-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4,5-dihydro-1H-purin-6-one;6-(6-piperidin-1-id-2-ylpiperidin-1-id-2-yl)-2H-pyridin-1-ide;platinum(2+)
• SMILES: C1=CC[N-]C(C2CCCC(C3CCCC[N-]3)[N-]2)=C1.NC1=NC2C(N=CN2C2OC(CO)C(O)C2O)C(=O)N1.[Pt+2]
• InChI: InChI=1S/C15H22N3.C10H15N5O5.Pt/c1-3-10-16-12(6-1)14-8-5-9-15(18-14)13-7-2-4-11-17-13;11-10-13-7-4(8(19)14-10)12-2-15(7)9-6(18)5(17)3(1-16)20-9;/h1,3,6,13-15H,2,4-5,7-11H2;2-7,9,16-18H,1H2,(H3,11,13,14,19);/q-3;;+2
• InChIKey: NGYPMISJFOXFRY-UHFFFAOYSA-N
• XLogP: -0.06
• TPSA: 195.30 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 9
• Rotatable Bonds: 4
• Heavy Atoms: 39
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	724.70
LogP ≤ 5	-0.06
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	9

Frequently Asked Questions

What is the IUPAC name of 2-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4,5-dihydro-1H-purin-6-one;6-(6-piperidin-1-id-2-ylpiperidin-1-id-2-yl)-2H-pyridin-1-ide;platinum(2+)?

The IUPAC name of 2-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4,5-dihydro-1H-purin-6-one;6-(6-piperidin-1-id-2-ylpiperidin-1-id-2-yl)-2H-pyridin-1-ide;platinum(2+) (CID 5246729) is 2-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4,5-dihydro-1H-purin-6-one;6-(6-piperidin-1-id-2-ylpiperidin-1-id-2-yl)-2H-pyridin-1-ide;platinum(2+).

What is the SMILES notation for 2-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4,5-dihydro-1H-purin-6-one;6-(6-piperidin-1-id-2-ylpiperidin-1-id-2-yl)-2H-pyridin-1-ide;platinum(2+)?

The canonical SMILES for 2-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4,5-dihydro-1H-purin-6-one;6-(6-piperidin-1-id-2-ylpiperidin-1-id-2-yl)-2H-pyridin-1-ide;platinum(2+) is C1=CC[N-]C(C2CCCC(C3CCCC[N-]3)[N-]2)=C1.NC1=NC2C(N=CN2C2OC(CO)C(O)C2O)C(=O)N1.[Pt+2].

What is the InChIKey of 2-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4,5-dihydro-1H-purin-6-one;6-(6-piperidin-1-id-2-ylpiperidin-1-id-2-yl)-2H-pyridin-1-ide;platinum(2+)?

The InChIKey is NGYPMISJFOXFRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N3.C10H15N5O5.Pt/c1-3-10-16-12(6-1)14-8-5-9-15(18-14)13-7-2-4-11-17-13;11-10-13-7-4(8(19)14-10)12-2-15(7)9-6(18)5(17)3(1-16)20-9;/h1,3,6,13-15H,2,4-5,7-11H2;2-7,9,16-18H,1H2,(H3,11,13,14,19);/q-3;;+2.

What are the key properties of 2-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4,5-dihydro-1H-purin-6-one;6-(6-piperidin-1-id-2-ylpiperidin-1-id-2-yl)-2H-pyridin-1-ide;platinum(2+)?

2-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4,5-dihydro-1H-purin-6-one;6-(6-piperidin-1-id-2-ylpiperidin-1-id-2-yl)-2H-pyridin-1-ide;platinum(2+) has a molecular weight of 724.70 g/mol, XLogP of -0.06, 4 rotatable bonds, 5 hydrogen bond donors, and 9 hydrogen bond acceptors.

Where does this data come from?

All data for 2-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4,5-dihydro-1H-purin-6-one;6-(6-piperidin-1-id-2-ylpiperidin-1-id-2-yl)-2H-pyridin-1-ide;platinum(2+) is sourced from PubChem (CID 5246729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).