azanide;cyclopentylazanide;3-(2,2-dichloroacetyl)oxycyclobutane-1,1-dicarboxylic acid;platinum(2+)

C13H20Cl2N2O6Pt — CID 140882843

IUPACazanide;cyclopentylazanide;3-(2,2-dichloroacetyl)oxycyclobutane-1,1-dicarboxylic acid;platinum(2+)
SMILESO=C(OC1CC(C(=O)O)(C(=O)O)C1)C(Cl)Cl.[NH-]C1CCCC1.[NH2-].[Pt+2]
InChIInChI=1S/C8H8Cl2O6.C5H10N.H2N.Pt/c9-4(10)5(11)16-3-1-8(2-3,6(12)13)7(14)15;6-5-3-1-2-4-5;;/h3-4H,1-2H2,(H,12,13)(H,14,15);5-6H,1-4H2;1H2;/q;2*-1;+2
InChIKeyAKHHZTFPDQNONM-UHFFFAOYSA-N
MW566.30 g/mol
LogP3.35
Rot. Bonds4

About azanide;cyclopentylazanide;3-(2,2-dichloroacetyl)oxycyclobutane-1,1-dicarboxylic acid;platinum(2+)

azanide;cyclopentylazanide;3-(2,2-dichloroacetyl)oxycyclobutane-1,1-dicarboxylic acid;platinum(2+) (PubChem CID 140882843) has the molecular formula C13H20Cl2N2O6Pt and a molecular weight of 566.30 g/mol. Its IUPAC name is azanide;cyclopentylazanide;3-(2,2-dichloroacetyl)oxycyclobutane-1,1-dicarboxylic acid;platinum(2+).

Molecular Properties

Compound Nameazanide;cyclopentylazanide;3-(2,2-dichloroacetyl)oxycyclobutane-1,1-dicarboxylic acid;platinum(2+)
PubChem CID140882843
Molecular FormulaC13H20Cl2N2O6Pt
Molecular Weight566.30 g/mol
Exact Mass565.03
IUPAC Nameazanide;cyclopentylazanide;3-(2,2-dichloroacetyl)oxycyclobutane-1,1-dicarboxylic acid;platinum(2+)
SMILESO=C(OC1CC(C(=O)O)(C(=O)O)C1)C(Cl)Cl.[NH-]C1CCCC1.[NH2-].[Pt+2]
InChIInChI=1S/C8H8Cl2O6.C5H10N.H2N.Pt/c9-4(10)5(11)16-3-1-8(2-3,6(12)13)7(14)15;6-5-3-1-2-4-5;;/h3-4H,1-2H2,(H,12,13)(H,14,15);5-6H,1-4H2;1H2;/q;2*-1;+2
InChIKeyAKHHZTFPDQNONM-UHFFFAOYSA-N
XLogP3.35
TPSA158.20 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500566.30
LogP ≤ 53.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze azanide;cyclopentylazanide;3-(2,2-dichloroacetyl)oxycyclobutane-1,1-dicarboxylic acid;platinum(2+) with MolForge

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Related Compounds

(4-azanidylcyclohexyl)azanide;cyclobutane-1,1-dicarboxylic acid;platinum(2+)
CID 24812607
1-cyclohexyloxycarbonylcyclopentane-1-carboxylic acid
CID 90449500
azanide;cyclohexylazanide;platinum(2+);dihydrate
CID 58480762
3-methoxycyclohexane-1,1-dicarboxylic acid
CID 18968479
(2-azanidylcyclohexyl)azanide;carbonic acid;platinum(2+)
CID 171717451
3-(5-cyclododecylpentyl)cyclobutane-1,1-dicarboxylic acid
CID 23344470
(1S)-1-amino-2-hydroxycyclohexane-1-carboxylic acid
CID 15813568
3-acetyloxycyclobutane-1,1-dicarboxylate;[2-(aminomethyl)cyclobutyl]methanamine;platinum(2+)
CID 42610849
cyclopentyl 2-aminobutanoate;hydrochloride
CID 175315314
cyclohexyl 2-(propan-2-ylamino)propanoate
CID 19362177
3-(cyclobutylmethyl)cyclobutane-1,1-dicarboxylic acid
CID 23344510
cyclopentyl (2S)-2-amino-2-cyclopropylacetate
CID 94554301

Frequently Asked Questions

What is the IUPAC name of azanide;cyclopentylazanide;3-(2,2-dichloroacetyl)oxycyclobutane-1,1-dicarboxylic acid;platinum(2+)?
The IUPAC name of azanide;cyclopentylazanide;3-(2,2-dichloroacetyl)oxycyclobutane-1,1-dicarboxylic acid;platinum(2+) (CID 140882843) is azanide;cyclopentylazanide;3-(2,2-dichloroacetyl)oxycyclobutane-1,1-dicarboxylic acid;platinum(2+).
What is the SMILES notation for azanide;cyclopentylazanide;3-(2,2-dichloroacetyl)oxycyclobutane-1,1-dicarboxylic acid;platinum(2+)?
The canonical SMILES for azanide;cyclopentylazanide;3-(2,2-dichloroacetyl)oxycyclobutane-1,1-dicarboxylic acid;platinum(2+) is O=C(OC1CC(C(=O)O)(C(=O)O)C1)C(Cl)Cl.[NH-]C1CCCC1.[NH2-].[Pt+2].
What is the InChIKey of azanide;cyclopentylazanide;3-(2,2-dichloroacetyl)oxycyclobutane-1,1-dicarboxylic acid;platinum(2+)?
The InChIKey is AKHHZTFPDQNONM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8Cl2O6.C5H10N.H2N.Pt/c9-4(10)5(11)16-3-1-8(2-3,6(12)13)7(14)15;6-5-3-1-2-4-5;;/h3-4H,1-2H2,(H,12,13)(H,14,15);5-6H,1-4H2;1H2;/q;2*-1;+2.
What are the key properties of azanide;cyclopentylazanide;3-(2,2-dichloroacetyl)oxycyclobutane-1,1-dicarboxylic acid;platinum(2+)?
azanide;cyclopentylazanide;3-(2,2-dichloroacetyl)oxycyclobutane-1,1-dicarboxylic acid;platinum(2+) has a molecular weight of 566.30 g/mol, XLogP of 3.35, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for azanide;cyclopentylazanide;3-(2,2-dichloroacetyl)oxycyclobutane-1,1-dicarboxylic acid;platinum(2+) is sourced from PubChem (CID 140882843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).