azanide;dichloroplatinum;N-hydroxy-7-[(2-methyl-4-pyridinyl)amino]heptanamide

C13H23Cl2N4O2Pt- — CID 58492755

IUPACazanide;dichloroplatinum;N-hydroxy-7-[(2-methyl-4-pyridinyl)amino]heptanamide
SMILESCc1cc(NCCCCCCC(=O)NO)ccn1.Cl[Pt]Cl.[NH2-]
InChIInChI=1S/C13H21N3O2.2ClH.H2N.Pt/c1-11-10-12(7-9-14-11)15-8-5-3-2-4-6-13(17)16-18;;;;/h7,9-10,18H,2-6,8H2,1H3,(H,14,15)(H,16,17);2*1H;1H2;/q;;;-1;+2/p-2
InChIKeyMCQWVAZJGUAADH-UHFFFAOYSA-L
MW533.34 g/mol
LogP4.35
Rot. Bonds8

About azanide;dichloroplatinum;N-hydroxy-7-[(2-methyl-4-pyridinyl)amino]heptanamide

azanide;dichloroplatinum;N-hydroxy-7-[(2-methyl-4-pyridinyl)amino]heptanamide (PubChem CID 58492755) has the molecular formula C13H23Cl2N4O2Pt- and a molecular weight of 533.34 g/mol. Its IUPAC name is azanide;dichloroplatinum;N-hydroxy-7-[(2-methyl-4-pyridinyl)amino]heptanamide.

Molecular Properties

Compound Nameazanide;dichloroplatinum;N-hydroxy-7-[(2-methyl-4-pyridinyl)amino]heptanamide
PubChem CID58492755
Molecular FormulaC13H23Cl2N4O2Pt-
Molecular Weight533.34 g/mol
Exact Mass532.09
IUPAC Nameazanide;dichloroplatinum;N-hydroxy-7-[(2-methyl-4-pyridinyl)amino]heptanamide
SMILESCc1cc(NCCCCCCC(=O)NO)ccn1.Cl[Pt]Cl.[NH2-]
InChIInChI=1S/C13H21N3O2.2ClH.H2N.Pt/c1-11-10-12(7-9-14-11)15-8-5-3-2-4-6-13(17)16-18;;;;/h7,9-10,18H,2-6,8H2,1H3,(H,14,15)(H,16,17);2*1H;1H2;/q;;;-1;+2/p-2
InChIKeyMCQWVAZJGUAADH-UHFFFAOYSA-L
XLogP4.35
TPSA107.75 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms22
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500533.34
LogP ≤ 54.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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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Frequently Asked Questions

What is the IUPAC name of azanide;dichloroplatinum;N-hydroxy-7-[(2-methyl-4-pyridinyl)amino]heptanamide?
The IUPAC name of azanide;dichloroplatinum;N-hydroxy-7-[(2-methyl-4-pyridinyl)amino]heptanamide (CID 58492755) is azanide;dichloroplatinum;N-hydroxy-7-[(2-methyl-4-pyridinyl)amino]heptanamide.
What is the SMILES notation for azanide;dichloroplatinum;N-hydroxy-7-[(2-methyl-4-pyridinyl)amino]heptanamide?
The canonical SMILES for azanide;dichloroplatinum;N-hydroxy-7-[(2-methyl-4-pyridinyl)amino]heptanamide is Cc1cc(NCCCCCCC(=O)NO)ccn1.Cl[Pt]Cl.[NH2-].
What is the InChIKey of azanide;dichloroplatinum;N-hydroxy-7-[(2-methyl-4-pyridinyl)amino]heptanamide?
The InChIKey is MCQWVAZJGUAADH-UHFFFAOYSA-L. The full InChI is InChI=1S/C13H21N3O2.2ClH.H2N.Pt/c1-11-10-12(7-9-14-11)15-8-5-3-2-4-6-13(17)16-18;;;;/h7,9-10,18H,2-6,8H2,1H3,(H,14,15)(H,16,17);2*1H;1H2;/q;;;-1;+2/p-2.
What are the key properties of azanide;dichloroplatinum;N-hydroxy-7-[(2-methyl-4-pyridinyl)amino]heptanamide?
azanide;dichloroplatinum;N-hydroxy-7-[(2-methyl-4-pyridinyl)amino]heptanamide has a molecular weight of 533.34 g/mol, XLogP of 4.35, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for azanide;dichloroplatinum;N-hydroxy-7-[(2-methyl-4-pyridinyl)amino]heptanamide is sourced from PubChem (CID 58492755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).