3-[4-(2-methoxypropyl)phenyl]piperidine

C15H23NO — CID 117339182

IUPAC3-[4-(2-methoxypropyl)phenyl]piperidine
SMILESCOC(C)Cc1ccc(C2CCCNC2)cc1
InChIInChI=1S/C15H23NO/c1-12(17-2)10-13-5-7-14(8-6-13)15-4-3-9-16-11-15/h5-8,12,15-16H,3-4,9-11H2,1-2H3
InChIKeyIAQMIYSCJCEDOX-UHFFFAOYSA-N
MW233.35 g/mol
LogP2.73
Rot. Bonds4

About 3-[4-(2-methoxypropyl)phenyl]piperidine

3-[4-(2-methoxypropyl)phenyl]piperidine (PubChem CID 117339182) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is 3-[4-(2-methoxypropyl)phenyl]piperidine.

Molecular Properties

Compound Name3-[4-(2-methoxypropyl)phenyl]piperidine
PubChem CID117339182
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC Name3-[4-(2-methoxypropyl)phenyl]piperidine
SMILESCOC(C)Cc1ccc(C2CCCNC2)cc1
InChIInChI=1S/C15H23NO/c1-12(17-2)10-13-5-7-14(8-6-13)15-4-3-9-16-11-15/h5-8,12,15-16H,3-4,9-11H2,1-2H3
InChIKeyIAQMIYSCJCEDOX-UHFFFAOYSA-N
XLogP2.73
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.35
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[4-(2-methoxypropyl)phenyl]piperidine
CID 117339147
3-[4-(2-fluoropropyl)phenyl]piperidine
CID 84687072
3-[4-(1-methoxyethyl)phenyl]piperidine
CID 117313118
3-(4-methoxyphenyl)piperidine
CID 12937920
3-(4-propan-2-ylphenyl)piperidine
CID 58015975
3-[4-(2,2-dimethylpropyl)phenyl]piperidine
CID 117335235
3-(4-piperidin-3-ylphenyl)propanoic acid
CID 116988287
3-(4-ethylphenyl)azepane
CID 83819662
N-[(4-piperidin-3-ylphenyl)methyl]ethanamine
CID 116988263
3-[4-(piperidin-3-ylmethyl)phenyl]piperidine
CID 116988274
1-[4-[(3S)-piperidin-3-yl]phenyl]ethanol
CID 154574830
2-[[4-(2-methoxypropyl)phenyl]methyl]piperidine
CID 117371935

Frequently Asked Questions

What is the IUPAC name of 3-[4-(2-methoxypropyl)phenyl]piperidine?
The IUPAC name of 3-[4-(2-methoxypropyl)phenyl]piperidine (CID 117339182) is 3-[4-(2-methoxypropyl)phenyl]piperidine.
What is the SMILES notation for 3-[4-(2-methoxypropyl)phenyl]piperidine?
The canonical SMILES for 3-[4-(2-methoxypropyl)phenyl]piperidine is COC(C)Cc1ccc(C2CCCNC2)cc1.
What is the InChIKey of 3-[4-(2-methoxypropyl)phenyl]piperidine?
The InChIKey is IAQMIYSCJCEDOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-12(17-2)10-13-5-7-14(8-6-13)15-4-3-9-16-11-15/h5-8,12,15-16H,3-4,9-11H2,1-2H3.
What are the key properties of 3-[4-(2-methoxypropyl)phenyl]piperidine?
3-[4-(2-methoxypropyl)phenyl]piperidine has a molecular weight of 233.35 g/mol, XLogP of 2.73, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(2-methoxypropyl)phenyl]piperidine is sourced from PubChem (CID 117339182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).