methyl-(1-methylpiperidin-4-yl)azanide;oxalic acid;platinum(2+)

C9H17N2O4Pt+ — CID 24812624

IUPACmethyl-(1-methylpiperidin-4-yl)azanide;oxalic acid;platinum(2+)
SMILESC[N-]C1CCN(C)CC1.O=C(O)C(=O)O.[Pt+2]
InChIInChI=1S/C7H15N2.C2H2O4.Pt/c1-8-7-3-5-9(2)6-4-7;3-1(4)2(5)6;/h7H,3-6H2,1-2H3;(H,3,4)(H,5,6);/q-1;;+2
InChIKeyFVBJAPQMXSJBIG-UHFFFAOYSA-N
MW412.32 g/mol
LogP0.24
Rot. Bonds1

About methyl-(1-methylpiperidin-4-yl)azanide;oxalic acid;platinum(2+)

methyl-(1-methylpiperidin-4-yl)azanide;oxalic acid;platinum(2+) (PubChem CID 24812624) has the molecular formula C9H17N2O4Pt+ and a molecular weight of 412.32 g/mol. Its IUPAC name is methyl-(1-methylpiperidin-4-yl)azanide;oxalic acid;platinum(2+).

Molecular Properties

Compound Namemethyl-(1-methylpiperidin-4-yl)azanide;oxalic acid;platinum(2+)
PubChem CID24812624
Molecular FormulaC9H17N2O4Pt+
Molecular Weight412.32 g/mol
Exact Mass412.08
IUPAC Namemethyl-(1-methylpiperidin-4-yl)azanide;oxalic acid;platinum(2+)
SMILESC[N-]C1CCN(C)CC1.O=C(O)C(=O)O.[Pt+2]
InChIInChI=1S/C7H15N2.C2H2O4.Pt/c1-8-7-3-5-9(2)6-4-7;3-1(4)2(5)6;/h7H,3-6H2,1-2H3;(H,3,4)(H,5,6);/q-1;;+2
InChIKeyFVBJAPQMXSJBIG-UHFFFAOYSA-N
XLogP0.24
TPSA91.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.32
LogP ≤ 50.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of methyl-(1-methylpiperidin-4-yl)azanide;oxalic acid;platinum(2+)?
The IUPAC name of methyl-(1-methylpiperidin-4-yl)azanide;oxalic acid;platinum(2+) (CID 24812624) is methyl-(1-methylpiperidin-4-yl)azanide;oxalic acid;platinum(2+).
What is the SMILES notation for methyl-(1-methylpiperidin-4-yl)azanide;oxalic acid;platinum(2+)?
The canonical SMILES for methyl-(1-methylpiperidin-4-yl)azanide;oxalic acid;platinum(2+) is C[N-]C1CCN(C)CC1.O=C(O)C(=O)O.[Pt+2].
What is the InChIKey of methyl-(1-methylpiperidin-4-yl)azanide;oxalic acid;platinum(2+)?
The InChIKey is FVBJAPQMXSJBIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N2.C2H2O4.Pt/c1-8-7-3-5-9(2)6-4-7;3-1(4)2(5)6;/h7H,3-6H2,1-2H3;(H,3,4)(H,5,6);/q-1;;+2.
What are the key properties of methyl-(1-methylpiperidin-4-yl)azanide;oxalic acid;platinum(2+)?
methyl-(1-methylpiperidin-4-yl)azanide;oxalic acid;platinum(2+) has a molecular weight of 412.32 g/mol, XLogP of 0.24, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl-(1-methylpiperidin-4-yl)azanide;oxalic acid;platinum(2+) is sourced from PubChem (CID 24812624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).