carbon monoxide;molybdenum;piperidine

C10H11MoNO5 — CID 12593331

IUPACcarbon monoxide;molybdenum;piperidine
SMILESC1CCNCC1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Mo]
InChIInChI=1S/C5H11N.5CO.Mo/c1-2-4-6-5-3-1;5*1-2;/h6H,1-5H2;;;;;;
InChIKeyOYDFBRFYGGTBEV-UHFFFAOYSA-N
MW321.14 g/mol
LogP0.57
Rot. Bonds

About carbon monoxide;molybdenum;piperidine

carbon monoxide;molybdenum;piperidine (PubChem CID 12593331) has the molecular formula C10H11MoNO5 and a molecular weight of 321.14 g/mol. Its IUPAC name is carbon monoxide;molybdenum;piperidine.

Molecular Properties

Compound Namecarbon monoxide;molybdenum;piperidine
PubChem CID12593331
Molecular FormulaC10H11MoNO5
Molecular Weight321.14 g/mol
Exact Mass322.97
IUPAC Namecarbon monoxide;molybdenum;piperidine
SMILESC1CCNCC1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Mo]
InChIInChI=1S/C5H11N.5CO.Mo/c1-2-4-6-5-3-1;5*1-2;/h6H,1-5H2;;;;;;
InChIKeyOYDFBRFYGGTBEV-UHFFFAOYSA-N
XLogP0.57
TPSA111.53 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.14
LogP ≤ 50.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of carbon monoxide;molybdenum;piperidine?
The IUPAC name of carbon monoxide;molybdenum;piperidine (CID 12593331) is carbon monoxide;molybdenum;piperidine.
What is the SMILES notation for carbon monoxide;molybdenum;piperidine?
The canonical SMILES for carbon monoxide;molybdenum;piperidine is C1CCNCC1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Mo].
What is the InChIKey of carbon monoxide;molybdenum;piperidine?
The InChIKey is OYDFBRFYGGTBEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11N.5CO.Mo/c1-2-4-6-5-3-1;5*1-2;/h6H,1-5H2;;;;;;.
What are the key properties of carbon monoxide;molybdenum;piperidine?
carbon monoxide;molybdenum;piperidine has a molecular weight of 321.14 g/mol, XLogP of 0.57, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for carbon monoxide;molybdenum;piperidine is sourced from PubChem (CID 12593331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).