4-benzylidene-1-propan-2-ylpiperidine

C15H21N — CID 23570306

IUPAC4-benzylidene-1-propan-2-ylpiperidine
SMILESCC(C)N1CCC(=Cc2ccccc2)CC1
InChIInChI=1S/C15H21N/c1-13(2)16-10-8-15(9-11-16)12-14-6-4-3-5-7-14/h3-7,12-13H,8-11H2,1-2H3
InChIKeyKFMOWTDAYLUSEN-UHFFFAOYSA-N
MW215.34 g/mol
LogP3.57
Rot. Bonds2

About 4-benzylidene-1-propan-2-ylpiperidine

4-benzylidene-1-propan-2-ylpiperidine (PubChem CID 23570306) has the molecular formula C15H21N and a molecular weight of 215.34 g/mol. Its IUPAC name is 4-benzylidene-1-propan-2-ylpiperidine.

Molecular Properties

Compound Name4-benzylidene-1-propan-2-ylpiperidine
PubChem CID23570306
Molecular FormulaC15H21N
Molecular Weight215.34 g/mol
Exact Mass215.17
IUPAC Name4-benzylidene-1-propan-2-ylpiperidine
SMILESCC(C)N1CCC(=Cc2ccccc2)CC1
InChIInChI=1S/C15H21N/c1-13(2)16-10-8-15(9-11-16)12-14-6-4-3-5-7-14/h3-7,12-13H,8-11H2,1-2H3
InChIKeyKFMOWTDAYLUSEN-UHFFFAOYSA-N
XLogP3.57
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 53.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-benzylidene-1-propan-2-ylpiperidine?
The IUPAC name of 4-benzylidene-1-propan-2-ylpiperidine (CID 23570306) is 4-benzylidene-1-propan-2-ylpiperidine.
What is the SMILES notation for 4-benzylidene-1-propan-2-ylpiperidine?
The canonical SMILES for 4-benzylidene-1-propan-2-ylpiperidine is CC(C)N1CCC(=Cc2ccccc2)CC1.
What is the InChIKey of 4-benzylidene-1-propan-2-ylpiperidine?
The InChIKey is KFMOWTDAYLUSEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N/c1-13(2)16-10-8-15(9-11-16)12-14-6-4-3-5-7-14/h3-7,12-13H,8-11H2,1-2H3.
What are the key properties of 4-benzylidene-1-propan-2-ylpiperidine?
4-benzylidene-1-propan-2-ylpiperidine has a molecular weight of 215.34 g/mol, XLogP of 3.57, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzylidene-1-propan-2-ylpiperidine is sourced from PubChem (CID 23570306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).