azane;N-hydroxy-7-[(6-methyl-3-pyridinyl)oxy]heptanamide;platinum(2+);dichloride

C13H23Cl2N3O3Pt — CID 46873182

IUPACazane;N-hydroxy-7-[(6-methyl-3-pyridinyl)oxy]heptanamide;platinum(2+);dichloride
SMILESCc1ccc(OCCCCCCC(=O)NO)cn1.N.[Cl-].[Cl-].[Pt+2]
InChIInChI=1S/C13H20N2O3.2ClH.H3N.Pt/c1-11-7-8-12(10-14-11)18-9-5-3-2-4-6-13(16)15-17;;;;/h7-8,10,17H,2-6,9H2,1H3,(H,15,16);2*1H;1H3;/q;;;;+2/p-2
InChIKeyAXBWYSWZMBOHCZ-UHFFFAOYSA-L
MW535.33 g/mol
LogP-3.61
Rot. Bonds8

About azane;N-hydroxy-7-[(6-methyl-3-pyridinyl)oxy]heptanamide;platinum(2+);dichloride

azane;N-hydroxy-7-[(6-methyl-3-pyridinyl)oxy]heptanamide;platinum(2+);dichloride (PubChem CID 46873182) has the molecular formula C13H23Cl2N3O3Pt and a molecular weight of 535.33 g/mol. Its IUPAC name is azane;N-hydroxy-7-[(6-methyl-3-pyridinyl)oxy]heptanamide;platinum(2+);dichloride.

Molecular Properties

Compound Nameazane;N-hydroxy-7-[(6-methyl-3-pyridinyl)oxy]heptanamide;platinum(2+);dichloride
PubChem CID46873182
Molecular FormulaC13H23Cl2N3O3Pt
Molecular Weight535.33 g/mol
Exact Mass534.08
IUPAC Nameazane;N-hydroxy-7-[(6-methyl-3-pyridinyl)oxy]heptanamide;platinum(2+);dichloride
SMILESCc1ccc(OCCCCCCC(=O)NO)cn1.N.[Cl-].[Cl-].[Pt+2]
InChIInChI=1S/C13H20N2O3.2ClH.H3N.Pt/c1-11-7-8-12(10-14-11)18-9-5-3-2-4-6-13(16)15-17;;;;/h7-8,10,17H,2-6,9H2,1H3,(H,15,16);2*1H;1H3;/q;;;;+2/p-2
InChIKeyAXBWYSWZMBOHCZ-UHFFFAOYSA-L
XLogP-3.61
TPSA106.45 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500535.33
LogP ≤ 5-3.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-hydroxy-7-[(6-methyl-3-pyridinyl)oxy]heptanamide
CID 46872843
7-[4-(4-aminophenyl)phenoxy]-N-hydroxyheptanamide
CID 89208200
5-butoxy-2-methylpyridine
CID 13154052
7-(4-cyclohexa-1,5-dien-3-yn-1-ylphenoxy)-N-hydroxyheptanamide
CID 142086769
7-(3-ethylphenoxy)-N-hydroxyheptanamide
CID 39364757
N-hydroxy-7-(2,4,5-trimethylphenoxy)heptanamide
CID 39379617
N-tert-butyl-4-[(6-methyl-3-pyridinyl)oxy]butan-1-amine
CID 55073143
4-hexoxy-N-[6-(hydroxyamino)-6-oxohexoxy]benzamide
CID 90681613
N-[6-(hydroxyamino)-6-oxohexoxy]-4-propoxybenzamide
CID 90681607
N-(3-aminopropyl)-N-methyl-3-[(6-methyl-3-pyridinyl)oxy]propanamide
CID 55030985
N-methyl-5-(4-methylphenoxy)pentanamide
CID 134582282
4-[2-[2-[(6-methyl-3-pyridinyl)oxy]ethyl]phenyl]butanoic acid
CID 137487819

Frequently Asked Questions

What is the IUPAC name of azane;N-hydroxy-7-[(6-methyl-3-pyridinyl)oxy]heptanamide;platinum(2+);dichloride?
The IUPAC name of azane;N-hydroxy-7-[(6-methyl-3-pyridinyl)oxy]heptanamide;platinum(2+);dichloride (CID 46873182) is azane;N-hydroxy-7-[(6-methyl-3-pyridinyl)oxy]heptanamide;platinum(2+);dichloride.
What is the SMILES notation for azane;N-hydroxy-7-[(6-methyl-3-pyridinyl)oxy]heptanamide;platinum(2+);dichloride?
The canonical SMILES for azane;N-hydroxy-7-[(6-methyl-3-pyridinyl)oxy]heptanamide;platinum(2+);dichloride is Cc1ccc(OCCCCCCC(=O)NO)cn1.N.[Cl-].[Cl-].[Pt+2].
What is the InChIKey of azane;N-hydroxy-7-[(6-methyl-3-pyridinyl)oxy]heptanamide;platinum(2+);dichloride?
The InChIKey is AXBWYSWZMBOHCZ-UHFFFAOYSA-L. The full InChI is InChI=1S/C13H20N2O3.2ClH.H3N.Pt/c1-11-7-8-12(10-14-11)18-9-5-3-2-4-6-13(16)15-17;;;;/h7-8,10,17H,2-6,9H2,1H3,(H,15,16);2*1H;1H3;/q;;;;+2/p-2.
What are the key properties of azane;N-hydroxy-7-[(6-methyl-3-pyridinyl)oxy]heptanamide;platinum(2+);dichloride?
azane;N-hydroxy-7-[(6-methyl-3-pyridinyl)oxy]heptanamide;platinum(2+);dichloride has a molecular weight of 535.33 g/mol, XLogP of -3.61, 8 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for azane;N-hydroxy-7-[(6-methyl-3-pyridinyl)oxy]heptanamide;platinum(2+);dichloride is sourced from PubChem (CID 46873182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).