hexan-1-imine;platinum;dihydrate

C6H17NO2Pt — CID 175690790

IUPAChexan-1-imine;platinum;dihydrate
SMILESO.O.[H]/N=C/CCCCC.[Pt]
InChIInChI=1S/C6H13N.2H2O.Pt/c1-2-3-4-5-6-7;;;/h6-7H,2-5H2,1H3;2*1H2;/b7-6+;;;
InChIKeyVBQLIKLPOMPAAY-ZMVRRDJGSA-N
MW330.29 g/mol
LogP0.56
Rot. Bonds4

About hexan-1-imine;platinum;dihydrate

hexan-1-imine;platinum;dihydrate (PubChem CID 175690790) has the molecular formula C6H17NO2Pt and a molecular weight of 330.29 g/mol. Its IUPAC name is hexan-1-imine;platinum;dihydrate.

Molecular Properties

Compound Namehexan-1-imine;platinum;dihydrate
PubChem CID175690790
Molecular FormulaC6H17NO2Pt
Molecular Weight330.29 g/mol
Exact Mass330.09
IUPAC Namehexan-1-imine;platinum;dihydrate
SMILESO.O.[H]/N=C/CCCCC.[Pt]
InChIInChI=1S/C6H13N.2H2O.Pt/c1-2-3-4-5-6-7;;;/h6-7H,2-5H2,1H3;2*1H2;/b7-6+;;;
InChIKeyVBQLIKLPOMPAAY-ZMVRRDJGSA-N
XLogP0.56
TPSA86.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.29
LogP ≤ 50.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

azane;hexan-1-imine
CID 158895938
dichlorocopper;hexan-1-imine
CID 175941191
bis(cobalt(3+));hexan-1-imine;trisulfate
CID 86757216
hexan-1-imine;platinum(4+);dicarbonate
CID 175704271
hexane-1,6-diimine;hydrochloride
CID 175422205
octane-1,5-diimine
CID 129214712
N-(3-iminopropyl)tetradecan-1-amine
CID 57007128
N-ethyl-4-iminobutan-1-amine
CID 155382614
6-methylnon-5-en-1-imine
CID 90789693
4-methylsulfanylbutan-1-imine
CID 88877345
3-propylsulfanylpropan-1-imine
CID 123742984
hexane;tetrahydrate
CID 174107213

Frequently Asked Questions

What is the IUPAC name of hexan-1-imine;platinum;dihydrate?
The IUPAC name of hexan-1-imine;platinum;dihydrate (CID 175690790) is hexan-1-imine;platinum;dihydrate.
What is the SMILES notation for hexan-1-imine;platinum;dihydrate?
The canonical SMILES for hexan-1-imine;platinum;dihydrate is O.O.[H]/N=C/CCCCC.[Pt].
What is the InChIKey of hexan-1-imine;platinum;dihydrate?
The InChIKey is VBQLIKLPOMPAAY-ZMVRRDJGSA-N. The full InChI is InChI=1S/C6H13N.2H2O.Pt/c1-2-3-4-5-6-7;;;/h6-7H,2-5H2,1H3;2*1H2;/b7-6+;;;.
What are the key properties of hexan-1-imine;platinum;dihydrate?
hexan-1-imine;platinum;dihydrate has a molecular weight of 330.29 g/mol, XLogP of 0.56, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for hexan-1-imine;platinum;dihydrate is sourced from PubChem (CID 175690790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).