[2-[4-(dimethylamino)-2-(hydroxymethyl)benzene-6-id-1-yl]-4-pyridinyl]methanol;3-methoxy-4-(4-methoxy-2-pyridinyl)-N,N-dimethylbenzene-5-id-1-amine;platinum(2+)

C30H34N4O4Pt — CID 58401395

About [2-[4-(dimethylamino)-2-(hydroxymethyl)benzene-6-id-1-yl]-4-pyridinyl]methanol;3-methoxy-4-(4-methoxy-2-pyridinyl)-N,N-dimethylbenzene-5-id-1-amine;platinum(2+)

[2-[4-(dimethylamino)-2-(hydroxymethyl)benzene-6-id-1-yl]-4-pyridinyl]methanol;3-methoxy-4-(4-methoxy-2-pyridinyl)-N,N-dimethylbenzene-5-id-1-amine;platinum(2+) (PubChem CID 58401395) has the molecular formula C30H34N4O4Pt and a molecular weight of 709.70 g/mol. Its IUPAC name is [2-[4-(dimethylamino)-2-(hydroxymethyl)benzene-6-id-1-yl]-4-pyridinyl]methanol;3-methoxy-4-(4-methoxy-2-pyridinyl)-N,N-dimethylbenzene-5-id-1-amine;platinum(2+).

Molecular Properties

• Compound Name: [2-[4-(dimethylamino)-2-(hydroxymethyl)benzene-6-id-1-yl]-4-pyridinyl]methanol;3-methoxy-4-(4-methoxy-2-pyridinyl)-N,N-dimethylbenzene-5-id-1-amine;platinum(2+)
• PubChem CID: 58401395
• Molecular Formula: C30H34N4O4Pt
• Molecular Weight: 709.70 g/mol
• Exact Mass: 709.22
• IUPAC Name: [2-[4-(dimethylamino)-2-(hydroxymethyl)benzene-6-id-1-yl]-4-pyridinyl]methanol;3-methoxy-4-(4-methoxy-2-pyridinyl)-N,N-dimethylbenzene-5-id-1-amine;platinum(2+)
• SMILES: CN(C)c1c[c-]c(-c2cc(CO)ccn2)c(CO)c1.COc1ccnc(-c2[c-]cc(N(C)C)cc2OC)c1.[Pt+2]
• InChI: InChI=1S/2C15H17N2O2.Pt/c1-17(2)11-5-6-13(15(9-11)19-4)14-10-12(18-3)7-8-16-14;1-17(2)13-3-4-14(12(8-13)10-19)15-7-11(9-18)5-6-16-15;/h5,7-10H,1-4H3;3,5-8,18-19H,9-10H2,1-2H3;/q2*-1;+2
• InChIKey: CHJKFDORKMBUJT-UHFFFAOYSA-N
• XLogP: 4.23
• TPSA: 91.18 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 8
• Rotatable Bonds: 8
• Heavy Atoms: 39
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	709.70
LogP ≤ 5	4.23
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	8

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of [2-[4-(dimethylamino)-2-(hydroxymethyl)benzene-6-id-1-yl]-4-pyridinyl]methanol;3-methoxy-4-(4-methoxy-2-pyridinyl)-N,N-dimethylbenzene-5-id-1-amine;platinum(2+)?

The IUPAC name of [2-[4-(dimethylamino)-2-(hydroxymethyl)benzene-6-id-1-yl]-4-pyridinyl]methanol;3-methoxy-4-(4-methoxy-2-pyridinyl)-N,N-dimethylbenzene-5-id-1-amine;platinum(2+) (CID 58401395) is [2-[4-(dimethylamino)-2-(hydroxymethyl)benzene-6-id-1-yl]-4-pyridinyl]methanol;3-methoxy-4-(4-methoxy-2-pyridinyl)-N,N-dimethylbenzene-5-id-1-amine;platinum(2+).

What is the SMILES notation for [2-[4-(dimethylamino)-2-(hydroxymethyl)benzene-6-id-1-yl]-4-pyridinyl]methanol;3-methoxy-4-(4-methoxy-2-pyridinyl)-N,N-dimethylbenzene-5-id-1-amine;platinum(2+)?

The canonical SMILES for [2-[4-(dimethylamino)-2-(hydroxymethyl)benzene-6-id-1-yl]-4-pyridinyl]methanol;3-methoxy-4-(4-methoxy-2-pyridinyl)-N,N-dimethylbenzene-5-id-1-amine;platinum(2+) is CN(C)c1c[c-]c(-c2cc(CO)ccn2)c(CO)c1.COc1ccnc(-c2[c-]cc(N(C)C)cc2OC)c1.[Pt+2].

What is the InChIKey of [2-[4-(dimethylamino)-2-(hydroxymethyl)benzene-6-id-1-yl]-4-pyridinyl]methanol;3-methoxy-4-(4-methoxy-2-pyridinyl)-N,N-dimethylbenzene-5-id-1-amine;platinum(2+)?

The InChIKey is CHJKFDORKMBUJT-UHFFFAOYSA-N. The full InChI is InChI=1S/2C15H17N2O2.Pt/c1-17(2)11-5-6-13(15(9-11)19-4)14-10-12(18-3)7-8-16-14;1-17(2)13-3-4-14(12(8-13)10-19)15-7-11(9-18)5-6-16-15;/h5,7-10H,1-4H3;3,5-8,18-19H,9-10H2,1-2H3;/q2*-1;+2.

What are the key properties of [2-[4-(dimethylamino)-2-(hydroxymethyl)benzene-6-id-1-yl]-4-pyridinyl]methanol;3-methoxy-4-(4-methoxy-2-pyridinyl)-N,N-dimethylbenzene-5-id-1-amine;platinum(2+)?

[2-[4-(dimethylamino)-2-(hydroxymethyl)benzene-6-id-1-yl]-4-pyridinyl]methanol;3-methoxy-4-(4-methoxy-2-pyridinyl)-N,N-dimethylbenzene-5-id-1-amine;platinum(2+) has a molecular weight of 709.70 g/mol, XLogP of 4.23, 8 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for [2-[4-(dimethylamino)-2-(hydroxymethyl)benzene-6-id-1-yl]-4-pyridinyl]methanol;3-methoxy-4-(4-methoxy-2-pyridinyl)-N,N-dimethylbenzene-5-id-1-amine;platinum(2+) is sourced from PubChem (CID 58401395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).