4-(2-methoxy-1-phenylethenyl)piperidine

C14H19NO — CID 67125303

IUPAC4-(2-methoxy-1-phenylethenyl)piperidine
SMILESCOC=C(c1ccccc1)C1CCNCC1
InChIInChI=1S/C14H19NO/c1-16-11-14(12-5-3-2-4-6-12)13-7-9-15-10-8-13/h2-6,11,13,15H,7-10H2,1H3
InChIKeyREBSSQOXUVRTRA-UHFFFAOYSA-N
MW217.31 g/mol
LogP2.67
Rot. Bonds3

About 4-(2-methoxy-1-phenylethenyl)piperidine

4-(2-methoxy-1-phenylethenyl)piperidine (PubChem CID 67125303) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is 4-(2-methoxy-1-phenylethenyl)piperidine.

Molecular Properties

Compound Name4-(2-methoxy-1-phenylethenyl)piperidine
PubChem CID67125303
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC Name4-(2-methoxy-1-phenylethenyl)piperidine
SMILESCOC=C(c1ccccc1)C1CCNCC1
InChIInChI=1S/C14H19NO/c1-16-11-14(12-5-3-2-4-6-12)13-7-9-15-10-8-13/h2-6,11,13,15H,7-10H2,1H3
InChIKeyREBSSQOXUVRTRA-UHFFFAOYSA-N
XLogP2.67
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxy-1-phenylethenyl)piperidine?
The IUPAC name of 4-(2-methoxy-1-phenylethenyl)piperidine (CID 67125303) is 4-(2-methoxy-1-phenylethenyl)piperidine.
What is the SMILES notation for 4-(2-methoxy-1-phenylethenyl)piperidine?
The canonical SMILES for 4-(2-methoxy-1-phenylethenyl)piperidine is COC=C(c1ccccc1)C1CCNCC1.
What is the InChIKey of 4-(2-methoxy-1-phenylethenyl)piperidine?
The InChIKey is REBSSQOXUVRTRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO/c1-16-11-14(12-5-3-2-4-6-12)13-7-9-15-10-8-13/h2-6,11,13,15H,7-10H2,1H3.
What are the key properties of 4-(2-methoxy-1-phenylethenyl)piperidine?
4-(2-methoxy-1-phenylethenyl)piperidine has a molecular weight of 217.31 g/mol, XLogP of 2.67, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxy-1-phenylethenyl)piperidine is sourced from PubChem (CID 67125303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).