piperidine-1-carboselenoate

C6H10NOSe- — CID 137316024

IUPACpiperidine-1-carboselenoate
SMILESO=C([Se-])N1CCCCC1
InChIInChI=1S/C6H11NOSe/c8-6(9)7-4-2-1-3-5-7/h1-5H2,(H,8,9)/p-1
InChIKeyUGYSKAOGLIAMPV-UHFFFAOYSA-M
MW191.11 g/mol
LogP0.76
Rot. Bonds

About piperidine-1-carboselenoate

piperidine-1-carboselenoate (PubChem CID 137316024) has the molecular formula C6H10NOSe- and a molecular weight of 191.11 g/mol. Its IUPAC name is piperidine-1-carboselenoate.

Molecular Properties

Compound Namepiperidine-1-carboselenoate
PubChem CID137316024
Molecular FormulaC6H10NOSe-
Molecular Weight191.11 g/mol
Exact Mass191.99
IUPAC Namepiperidine-1-carboselenoate
SMILESO=C([Se-])N1CCCCC1
InChIInChI=1S/C6H11NOSe/c8-6(9)7-4-2-1-3-5-7/h1-5H2,(H,8,9)/p-1
InChIKeyUGYSKAOGLIAMPV-UHFFFAOYSA-M
XLogP0.76
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.11
LogP ≤ 50.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-Piperidinecarboxaldehyde
CID 17429
1-Piperidinecarbonyl chloride
CID 242085
Lithium piperidin-1-ylmethanone
CID 12464075
Piperidine carboxylate
CID 21874245
Piperidine-1-carbonyl bromide
CID 45081720
Piperidine-1-carbonyl fluoride
CID 87612054
Piperidine-1-carbothioate
CID 21933506
CID 23704783
CID 23704783
piperidine-1-carbothioic S-acid
CID 422915
CID 12225352
CID 12225352
Deuterio(piperidin-1-yl)methanone
CID 12464076
Piperidine-1-carbaldehyde;hydrochloride
CID 21392584

Frequently Asked Questions

What is the IUPAC name of piperidine-1-carboselenoate?
The IUPAC name of piperidine-1-carboselenoate (CID 137316024) is piperidine-1-carboselenoate.
What is the SMILES notation for piperidine-1-carboselenoate?
The canonical SMILES for piperidine-1-carboselenoate is O=C([Se-])N1CCCCC1.
What is the InChIKey of piperidine-1-carboselenoate?
The InChIKey is UGYSKAOGLIAMPV-UHFFFAOYSA-M. The full InChI is InChI=1S/C6H11NOSe/c8-6(9)7-4-2-1-3-5-7/h1-5H2,(H,8,9)/p-1.
What are the key properties of piperidine-1-carboselenoate?
piperidine-1-carboselenoate has a molecular weight of 191.11 g/mol, XLogP of 0.76, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for piperidine-1-carboselenoate is sourced from PubChem (CID 137316024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).