4-(3-phenylpropylidene)piperidine

C14H19N — CID 19703226

IUPAC4-(3-phenylpropylidene)piperidine
SMILESC(CCc1ccccc1)=C1CCNCC1
InChIInChI=1S/C14H19N/c1-2-5-13(6-3-1)7-4-8-14-9-11-15-12-10-14/h1-3,5-6,8,15H,4,7,9-12H2
InChIKeyURNWLJJIOFGGOV-UHFFFAOYSA-N
MW201.31 g/mol
LogP2.93
Rot. Bonds3

About 4-(3-phenylpropylidene)piperidine

4-(3-phenylpropylidene)piperidine (PubChem CID 19703226) has the molecular formula C14H19N and a molecular weight of 201.31 g/mol. Its IUPAC name is 4-(3-phenylpropylidene)piperidine.

Molecular Properties

Compound Name4-(3-phenylpropylidene)piperidine
PubChem CID19703226
Molecular FormulaC14H19N
Molecular Weight201.31 g/mol
Exact Mass201.15
IUPAC Name4-(3-phenylpropylidene)piperidine
SMILESC(CCc1ccccc1)=C1CCNCC1
InChIInChI=1S/C14H19N/c1-2-5-13(6-3-1)7-4-8-14-9-11-15-12-10-14/h1-3,5-6,8,15H,4,7,9-12H2
InChIKeyURNWLJJIOFGGOV-UHFFFAOYSA-N
XLogP2.93
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

bis(1-(2-phenylethyl)piperazine);dihydrochloride
CID 102602644
2-phenylethanol;piperidine
CID 143551130
N-methoxy-3-phenylpropan-1-imine
CID 73200493
benzene;2-phenylethylbenzene
CID 18982764
[(E)-5-cyclohexylidenepent-3-enyl]benzene
CID 101127606
but-3-enylbenzene;silver
CID 174999453
1-(8-phenyloctyl)-1,4,7,10-tetrazacyclododecane
CID 137439180
N-benzyl-2-piperazin-1-ylethanamine
CID 14900561
2-phenylacetaldehyde;pyrrolidine
CID 23356706
pent-3-enylbenzene
CID 519421
1-(2-phenylethyl)-1,4,8,11-tetrazacyclotetradecane
CID 14869439
hafnium;2-phenylethylbenzene
CID 173109801

Frequently Asked Questions

What is the IUPAC name of 4-(3-phenylpropylidene)piperidine?
The IUPAC name of 4-(3-phenylpropylidene)piperidine (CID 19703226) is 4-(3-phenylpropylidene)piperidine.
What is the SMILES notation for 4-(3-phenylpropylidene)piperidine?
The canonical SMILES for 4-(3-phenylpropylidene)piperidine is C(CCc1ccccc1)=C1CCNCC1.
What is the InChIKey of 4-(3-phenylpropylidene)piperidine?
The InChIKey is URNWLJJIOFGGOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N/c1-2-5-13(6-3-1)7-4-8-14-9-11-15-12-10-14/h1-3,5-6,8,15H,4,7,9-12H2.
What are the key properties of 4-(3-phenylpropylidene)piperidine?
4-(3-phenylpropylidene)piperidine has a molecular weight of 201.31 g/mol, XLogP of 2.93, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-phenylpropylidene)piperidine is sourced from PubChem (CID 19703226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).