1-Selenocarbamoylpiperidine

C6H11N2Se — CID 11171504

IUPAC—
SMILES[H]/N=C(\[Se])N1CCCCC1
InChIInChI=1S/C6H11N2Se/c7-6(9)8-4-2-1-3-5-8/h7H,1-5H2/b7-6-
InChIKeyCRINPZKZPCZMDJ-SREVYHEPSA-N
MW190.13 g/mol
LogP0.58
Rot. Bonds

About 1-Selenocarbamoylpiperidine

1-Selenocarbamoylpiperidine (PubChem CID 11171504) has the molecular formula C6H11N2Se and a molecular weight of 190.13 g/mol.

Molecular Properties

Compound Name1-Selenocarbamoylpiperidine
PubChem CID11171504
Molecular FormulaC6H11N2Se
Molecular Weight190.13 g/mol
Exact Mass191.01
IUPAC Name—
SMILES[H]/N=C(\[Se])N1CCCCC1
InChIInChI=1S/C6H11N2Se/c7-6(9)8-4-2-1-3-5-8/h7H,1-5H2/b7-6-
InChIKeyCRINPZKZPCZMDJ-SREVYHEPSA-N
XLogP0.58
TPSA27.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.13
LogP ≤ 50.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-Selenocarbamoylpiperidine?
The IUPAC name of 1-Selenocarbamoylpiperidine (CID 11171504) is not available.
What is the SMILES notation for 1-Selenocarbamoylpiperidine?
The canonical SMILES for 1-Selenocarbamoylpiperidine is [H]/N=C(\[Se])N1CCCCC1.
What is the InChIKey of 1-Selenocarbamoylpiperidine?
The InChIKey is CRINPZKZPCZMDJ-SREVYHEPSA-N. The full InChI is InChI=1S/C6H11N2Se/c7-6(9)8-4-2-1-3-5-8/h7H,1-5H2/b7-6-.
What are the key properties of 1-Selenocarbamoylpiperidine?
1-Selenocarbamoylpiperidine has a molecular weight of 190.13 g/mol, XLogP of 0.58, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-Selenocarbamoylpiperidine is sourced from PubChem (CID 11171504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).