6-methyl-2-phenyl-3-prop-1-en-2-ylpiperidine

C15H21N — CID 3834468

IUPAC6-methyl-2-phenyl-3-prop-1-en-2-ylpiperidine
SMILESC=C(C)C1CCC(C)NC1c1ccccc1
InChIInChI=1S/C15H21N/c1-11(2)14-10-9-12(3)16-15(14)13-7-5-4-6-8-13/h4-8,12,14-16H,1,9-10H2,2-3H3
InChIKeyCKCFIDBXBOJKMO-UHFFFAOYSA-N
MW215.34 g/mol
LogP3.69
Rot. Bonds2

About 6-methyl-2-phenyl-3-prop-1-en-2-ylpiperidine

6-methyl-2-phenyl-3-prop-1-en-2-ylpiperidine (PubChem CID 3834468) has the molecular formula C15H21N and a molecular weight of 215.34 g/mol. Its IUPAC name is 6-methyl-2-phenyl-3-prop-1-en-2-ylpiperidine.

Molecular Properties

Compound Name6-methyl-2-phenyl-3-prop-1-en-2-ylpiperidine
PubChem CID3834468
Molecular FormulaC15H21N
Molecular Weight215.34 g/mol
Exact Mass215.17
IUPAC Name6-methyl-2-phenyl-3-prop-1-en-2-ylpiperidine
SMILESC=C(C)C1CCC(C)NC1c1ccccc1
InChIInChI=1S/C15H21N/c1-11(2)14-10-9-12(3)16-15(14)13-7-5-4-6-8-13/h4-8,12,14-16H,1,9-10H2,2-3H3
InChIKeyCKCFIDBXBOJKMO-UHFFFAOYSA-N
XLogP3.69
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-phenyl-3-prop-1-en-2-ylpiperidine?
The IUPAC name of 6-methyl-2-phenyl-3-prop-1-en-2-ylpiperidine (CID 3834468) is 6-methyl-2-phenyl-3-prop-1-en-2-ylpiperidine.
What is the SMILES notation for 6-methyl-2-phenyl-3-prop-1-en-2-ylpiperidine?
The canonical SMILES for 6-methyl-2-phenyl-3-prop-1-en-2-ylpiperidine is C=C(C)C1CCC(C)NC1c1ccccc1.
What is the InChIKey of 6-methyl-2-phenyl-3-prop-1-en-2-ylpiperidine?
The InChIKey is CKCFIDBXBOJKMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N/c1-11(2)14-10-9-12(3)16-15(14)13-7-5-4-6-8-13/h4-8,12,14-16H,1,9-10H2,2-3H3.
What are the key properties of 6-methyl-2-phenyl-3-prop-1-en-2-ylpiperidine?
6-methyl-2-phenyl-3-prop-1-en-2-ylpiperidine has a molecular weight of 215.34 g/mol, XLogP of 3.69, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-phenyl-3-prop-1-en-2-ylpiperidine is sourced from PubChem (CID 3834468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).