4-[(E)-prop-1-enyl]-2H-pyridin-2-ide;rubidium(1+)

C8H8NRb — CID 153348546

IUPAC4-[(E)-prop-1-enyl]-2H-pyridin-2-ide;rubidium(1+)
SMILESC/C=C/c1c[c-]ncc1.[Rb+]
InChIInChI=1S/C8H8N.Rb/c1-2-3-8-4-6-9-7-5-8;/h2-6H,1H3;/q-1;+1/b3-2+;
InChIKeyVOBSCMXSZFGCKY-SQQVDAMQSA-N
MW203.63 g/mol
LogP-1.08
Rot. Bonds1

About 4-[(E)-prop-1-enyl]-2H-pyridin-2-ide;rubidium(1+)

4-[(E)-prop-1-enyl]-2H-pyridin-2-ide;rubidium(1+) (PubChem CID 153348546) has the molecular formula C8H8NRb and a molecular weight of 203.63 g/mol. Its IUPAC name is 4-[(E)-prop-1-enyl]-2H-pyridin-2-ide;rubidium(1+).

Molecular Properties

Compound Name4-[(E)-prop-1-enyl]-2H-pyridin-2-ide;rubidium(1+)
PubChem CID153348546
Molecular FormulaC8H8NRb
Molecular Weight203.63 g/mol
Exact Mass202.98
IUPAC Name4-[(E)-prop-1-enyl]-2H-pyridin-2-ide;rubidium(1+)
SMILESC/C=C/c1c[c-]ncc1.[Rb+]
InChIInChI=1S/C8H8N.Rb/c1-2-3-8-4-6-9-7-5-8;/h2-6H,1H3;/q-1;+1/b3-2+;
InChIKeyVOBSCMXSZFGCKY-SQQVDAMQSA-N
XLogP-1.08
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.63
LogP ≤ 5-1.08
H-Bond Donors ≤ 50
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 4-[(E)-prop-1-enyl]-2H-pyridin-2-ide;rubidium(1+)?
The IUPAC name of 4-[(E)-prop-1-enyl]-2H-pyridin-2-ide;rubidium(1+) (CID 153348546) is 4-[(E)-prop-1-enyl]-2H-pyridin-2-ide;rubidium(1+).
What is the SMILES notation for 4-[(E)-prop-1-enyl]-2H-pyridin-2-ide;rubidium(1+)?
The canonical SMILES for 4-[(E)-prop-1-enyl]-2H-pyridin-2-ide;rubidium(1+) is C/C=C/c1c[c-]ncc1.[Rb+].
What is the InChIKey of 4-[(E)-prop-1-enyl]-2H-pyridin-2-ide;rubidium(1+)?
The InChIKey is VOBSCMXSZFGCKY-SQQVDAMQSA-N. The full InChI is InChI=1S/C8H8N.Rb/c1-2-3-8-4-6-9-7-5-8;/h2-6H,1H3;/q-1;+1/b3-2+;.
What are the key properties of 4-[(E)-prop-1-enyl]-2H-pyridin-2-ide;rubidium(1+)?
4-[(E)-prop-1-enyl]-2H-pyridin-2-ide;rubidium(1+) has a molecular weight of 203.63 g/mol, XLogP of -1.08, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(E)-prop-1-enyl]-2H-pyridin-2-ide;rubidium(1+) is sourced from PubChem (CID 153348546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).