3-[1-(4-methylphenyl)propyl]piperidine

C15H23N — CID 83910141

IUPAC3-[1-(4-methylphenyl)propyl]piperidine
SMILESCCC(c1ccc(C)cc1)C1CCCNC1
InChIInChI=1S/C15H23N/c1-3-15(14-5-4-10-16-11-14)13-8-6-12(2)7-9-13/h6-9,14-16H,3-5,10-11H2,1-2H3
InChIKeyWMFZMQCDTJDBAG-UHFFFAOYSA-N
MW217.36 g/mol
LogP3.49
Rot. Bonds3

About 3-[1-(4-methylphenyl)propyl]piperidine

3-[1-(4-methylphenyl)propyl]piperidine (PubChem CID 83910141) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is 3-[1-(4-methylphenyl)propyl]piperidine.

Molecular Properties

Compound Name3-[1-(4-methylphenyl)propyl]piperidine
PubChem CID83910141
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC Name3-[1-(4-methylphenyl)propyl]piperidine
SMILESCCC(c1ccc(C)cc1)C1CCCNC1
InChIInChI=1S/C15H23N/c1-3-15(14-5-4-10-16-11-14)13-8-6-12(2)7-9-13/h6-9,14-16H,3-5,10-11H2,1-2H3
InChIKeyWMFZMQCDTJDBAG-UHFFFAOYSA-N
XLogP3.49
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-[1-(4-fluorophenyl)propyl]piperidine
CID 83910611
(4-methylphenyl)-piperidin-3-ylmethanol
CID 43146496
3-[1-(2,3-dihydro-1H-inden-5-yl)propyl]pyrrolidine
CID 83911483
4-(1-pyrrolidin-3-ylpropyl)benzene-1,2-diol
CID 83910553
4-(1-piperidin-3-ylethyl)phenol
CID 83908771
(1R)-1-(4-methylphenyl)-N-(piperidin-3-ylmethyl)ethanamine
CID 81349439
3-[1-(2-fluorophenyl)propyl]piperidine;sulfuryl dichloride
CID 174919101
2-cyclobutyl-2-(4-methylphenyl)ethanamine
CID 55269565
4-[1-(4-fluorophenyl)propyl]piperidine;hydrochloride
CID 175461872
N-methyl-1-(4-methylphenyl)-2-piperidin-3-ylethanamine
CID 116951716
N,N-dimethyl-4-(1-piperidin-3-ylethyl)aniline
CID 83911736
(4-ethoxyphenyl)-piperidin-3-ylmethanamine
CID 116935799

Frequently Asked Questions

What is the IUPAC name of 3-[1-(4-methylphenyl)propyl]piperidine?
The IUPAC name of 3-[1-(4-methylphenyl)propyl]piperidine (CID 83910141) is 3-[1-(4-methylphenyl)propyl]piperidine.
What is the SMILES notation for 3-[1-(4-methylphenyl)propyl]piperidine?
The canonical SMILES for 3-[1-(4-methylphenyl)propyl]piperidine is CCC(c1ccc(C)cc1)C1CCCNC1.
What is the InChIKey of 3-[1-(4-methylphenyl)propyl]piperidine?
The InChIKey is WMFZMQCDTJDBAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c1-3-15(14-5-4-10-16-11-14)13-8-6-12(2)7-9-13/h6-9,14-16H,3-5,10-11H2,1-2H3.
What are the key properties of 3-[1-(4-methylphenyl)propyl]piperidine?
3-[1-(4-methylphenyl)propyl]piperidine has a molecular weight of 217.36 g/mol, XLogP of 3.49, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(4-methylphenyl)propyl]piperidine is sourced from PubChem (CID 83910141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).