2-[(Z)-prop-1-enyl]piperidin-3-ide;yttrium

C8H13NY-2 — CID 58247604

IUPAC2-[(Z)-prop-1-enyl]piperidin-3-ide;yttrium
SMILES[CH2-]/C=C\C1[CH-]CCCN1.[Y]
InChIInChI=1S/C8H13N.Y/c1-2-5-8-6-3-4-7-9-8;/h2,5-6,8-9H,1,3-4,7H2;/q-2;/b5-2-;
InChIKeyXJTSHNGLXZVIOT-PVOKDAACSA-N
MW212.10 g/mol
LogP1.33
Rot. Bonds1

About 2-[(Z)-prop-1-enyl]piperidin-3-ide;yttrium

2-[(Z)-prop-1-enyl]piperidin-3-ide;yttrium (PubChem CID 58247604) has the molecular formula C8H13NY-2 and a molecular weight of 212.10 g/mol. Its IUPAC name is 2-[(Z)-prop-1-enyl]piperidin-3-ide;yttrium.

Molecular Properties

Compound Name2-[(Z)-prop-1-enyl]piperidin-3-ide;yttrium
PubChem CID58247604
Molecular FormulaC8H13NY-2
Molecular Weight212.10 g/mol
Exact Mass212.01
IUPAC Name2-[(Z)-prop-1-enyl]piperidin-3-ide;yttrium
SMILES[CH2-]/C=C\C1[CH-]CCCN1.[Y]
InChIInChI=1S/C8H13N.Y/c1-2-5-8-6-3-4-7-9-8;/h2,5-6,8-9H,1,3-4,7H2;/q-2;/b5-2-;
InChIKeyXJTSHNGLXZVIOT-PVOKDAACSA-N
XLogP1.33
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.10
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[(Z)-prop-1-enyl]piperidin-3-ide;yttrium?
The IUPAC name of 2-[(Z)-prop-1-enyl]piperidin-3-ide;yttrium (CID 58247604) is 2-[(Z)-prop-1-enyl]piperidin-3-ide;yttrium.
What is the SMILES notation for 2-[(Z)-prop-1-enyl]piperidin-3-ide;yttrium?
The canonical SMILES for 2-[(Z)-prop-1-enyl]piperidin-3-ide;yttrium is [CH2-]/C=C\C1[CH-]CCCN1.[Y].
What is the InChIKey of 2-[(Z)-prop-1-enyl]piperidin-3-ide;yttrium?
The InChIKey is XJTSHNGLXZVIOT-PVOKDAACSA-N. The full InChI is InChI=1S/C8H13N.Y/c1-2-5-8-6-3-4-7-9-8;/h2,5-6,8-9H,1,3-4,7H2;/q-2;/b5-2-;.
What are the key properties of 2-[(Z)-prop-1-enyl]piperidin-3-ide;yttrium?
2-[(Z)-prop-1-enyl]piperidin-3-ide;yttrium has a molecular weight of 212.10 g/mol, XLogP of 1.33, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(Z)-prop-1-enyl]piperidin-3-ide;yttrium is sourced from PubChem (CID 58247604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).