(4-azanidylcyclohexyl)azanide;cyclobutane-1,1-dicarboxylic acid;platinum(2+)

C12H20N2O4Pt — CID 24812607

IUPAC(4-azanidylcyclohexyl)azanide;cyclobutane-1,1-dicarboxylic acid;platinum(2+)
SMILESO=C(O)C1(C(=O)O)CCC1.[NH-]C1CCC([NH-])CC1.[Pt+2]
InChIInChI=1S/C6H12N2.C6H8O4.Pt/c7-5-1-2-6(8)4-3-5;7-4(8)6(5(9)10)2-1-3-6;/h5-8H,1-4H2;1-3H2,(H,7,8)(H,9,10);/q-2;;+2
InChIKeyVSUXRAQMMMAXRJ-UHFFFAOYSA-N
MW451.38 g/mol
LogP2.73
Rot. Bonds2

About (4-azanidylcyclohexyl)azanide;cyclobutane-1,1-dicarboxylic acid;platinum(2+)

(4-azanidylcyclohexyl)azanide;cyclobutane-1,1-dicarboxylic acid;platinum(2+) (PubChem CID 24812607) has the molecular formula C12H20N2O4Pt and a molecular weight of 451.38 g/mol. Its IUPAC name is (4-azanidylcyclohexyl)azanide;cyclobutane-1,1-dicarboxylic acid;platinum(2+).

Molecular Properties

Compound Name(4-azanidylcyclohexyl)azanide;cyclobutane-1,1-dicarboxylic acid;platinum(2+)
PubChem CID24812607
Molecular FormulaC12H20N2O4Pt
Molecular Weight451.38 g/mol
Exact Mass451.11
IUPAC Name(4-azanidylcyclohexyl)azanide;cyclobutane-1,1-dicarboxylic acid;platinum(2+)
SMILESO=C(O)C1(C(=O)O)CCC1.[NH-]C1CCC([NH-])CC1.[Pt+2]
InChIInChI=1S/C6H12N2.C6H8O4.Pt/c7-5-1-2-6(8)4-3-5;7-4(8)6(5(9)10)2-1-3-6;/h5-8H,1-4H2;1-3H2,(H,7,8)(H,9,10);/q-2;;+2
InChIKeyVSUXRAQMMMAXRJ-UHFFFAOYSA-N
XLogP2.73
TPSA122.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500451.38
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Related Compounds

cyclooctane-1,1-dicarboxylic acid
CID 18521139
CID 69418768
CID 69418768
cyclohexane-1,1-dicarboxylic acid
CID 70539849
cyclopentane-1,1-dicarboxylic acid;dihydrobromide
CID 90449229
cyclotritriacontane-1,1,12,12,23,23-hexacarboxylic acid
CID 132573281
azanide;cyclobutane-1,1-dicarboxylic acid;methane;methylazanide;platinum(2+)
CID 158096508
cadmium;cyclohexane-1,1-dicarboxylic acid
CID 175391690
alumane;cyclohexane-1,1-dicarboxylic acid
CID 175587551
cyclohexane-1,1-dicarboxylic acid;zinc
CID 134612672
azane;cyclobutane-1,1-dicarboxylic acid;methane;platinum
CID 161144544
cyclohexane;cyclohexane-1,1-dicarboxylic acid;methanol
CID 67028840
azane;bis(1-carboxycyclobutane-1-carboxylate);platinum(2+)
CID 10301374

Frequently Asked Questions

What is the IUPAC name of (4-azanidylcyclohexyl)azanide;cyclobutane-1,1-dicarboxylic acid;platinum(2+)?
The IUPAC name of (4-azanidylcyclohexyl)azanide;cyclobutane-1,1-dicarboxylic acid;platinum(2+) (CID 24812607) is (4-azanidylcyclohexyl)azanide;cyclobutane-1,1-dicarboxylic acid;platinum(2+).
What is the SMILES notation for (4-azanidylcyclohexyl)azanide;cyclobutane-1,1-dicarboxylic acid;platinum(2+)?
The canonical SMILES for (4-azanidylcyclohexyl)azanide;cyclobutane-1,1-dicarboxylic acid;platinum(2+) is O=C(O)C1(C(=O)O)CCC1.[NH-]C1CCC([NH-])CC1.[Pt+2].
What is the InChIKey of (4-azanidylcyclohexyl)azanide;cyclobutane-1,1-dicarboxylic acid;platinum(2+)?
The InChIKey is VSUXRAQMMMAXRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2.C6H8O4.Pt/c7-5-1-2-6(8)4-3-5;7-4(8)6(5(9)10)2-1-3-6;/h5-8H,1-4H2;1-3H2,(H,7,8)(H,9,10);/q-2;;+2.
What are the key properties of (4-azanidylcyclohexyl)azanide;cyclobutane-1,1-dicarboxylic acid;platinum(2+)?
(4-azanidylcyclohexyl)azanide;cyclobutane-1,1-dicarboxylic acid;platinum(2+) has a molecular weight of 451.38 g/mol, XLogP of 2.73, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-azanidylcyclohexyl)azanide;cyclobutane-1,1-dicarboxylic acid;platinum(2+) is sourced from PubChem (CID 24812607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).