benzene;chloroosmium;2-cyclohexylpiperidin-1-ide

C17H25ClNOs-2 — CID 11985645

IUPACbenzene;chloroosmium;2-cyclohexylpiperidin-1-ide
SMILESCl[Os].[CH-]1CCCCC1C1CCCC[N-]1.c1ccccc1
InChIInChI=1S/C11H19N.C6H6.ClH.Os/c1-2-6-10(7-3-1)11-8-4-5-9-12-11;1-2-4-6-5-3-1;;/h6,10-11H,1-5,7-9H2;1-6H;1H;/q-2;;;+1/p-1
InChIKeyLKTVJONCYVNVBS-UHFFFAOYSA-M
MW469.08 g/mol
LogP5.68
Rot. Bonds1

About benzene;chloroosmium;2-cyclohexylpiperidin-1-ide

benzene;chloroosmium;2-cyclohexylpiperidin-1-ide (PubChem CID 11985645) has the molecular formula C17H25ClNOs-2 and a molecular weight of 469.08 g/mol. Its IUPAC name is benzene;chloroosmium;2-cyclohexylpiperidin-1-ide.

Molecular Properties

Compound Namebenzene;chloroosmium;2-cyclohexylpiperidin-1-ide
PubChem CID11985645
Molecular FormulaC17H25ClNOs-2
Molecular Weight469.08 g/mol
Exact Mass470.13
IUPAC Namebenzene;chloroosmium;2-cyclohexylpiperidin-1-ide
SMILESCl[Os].[CH-]1CCCCC1C1CCCC[N-]1.c1ccccc1
InChIInChI=1S/C11H19N.C6H6.ClH.Os/c1-2-6-10(7-3-1)11-8-4-5-9-12-11;1-2-4-6-5-3-1;;/h6,10-11H,1-5,7-9H2;1-6H;1H;/q-2;;;+1/p-1
InChIKeyLKTVJONCYVNVBS-UHFFFAOYSA-M
XLogP5.68
TPSA14.10 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500469.08
LogP ≤ 55.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Related Compounds

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CID 160520949
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CID 135043210
bis(1-cyclohexyl-4,4,4-trifluorobutane-1,3-diol);manganese(2+);6-piperidin-1-id-2-yl-3,6-dihydro-2H-pyridin-1-ide
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Frequently Asked Questions

What is the IUPAC name of benzene;chloroosmium;2-cyclohexylpiperidin-1-ide?
The IUPAC name of benzene;chloroosmium;2-cyclohexylpiperidin-1-ide (CID 11985645) is benzene;chloroosmium;2-cyclohexylpiperidin-1-ide.
What is the SMILES notation for benzene;chloroosmium;2-cyclohexylpiperidin-1-ide?
The canonical SMILES for benzene;chloroosmium;2-cyclohexylpiperidin-1-ide is Cl[Os].[CH-]1CCCCC1C1CCCC[N-]1.c1ccccc1.
What is the InChIKey of benzene;chloroosmium;2-cyclohexylpiperidin-1-ide?
The InChIKey is LKTVJONCYVNVBS-UHFFFAOYSA-M. The full InChI is InChI=1S/C11H19N.C6H6.ClH.Os/c1-2-6-10(7-3-1)11-8-4-5-9-12-11;1-2-4-6-5-3-1;;/h6,10-11H,1-5,7-9H2;1-6H;1H;/q-2;;;+1/p-1.
What are the key properties of benzene;chloroosmium;2-cyclohexylpiperidin-1-ide?
benzene;chloroosmium;2-cyclohexylpiperidin-1-ide has a molecular weight of 469.08 g/mol, XLogP of 5.68, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for benzene;chloroosmium;2-cyclohexylpiperidin-1-ide is sourced from PubChem (CID 11985645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).