3-(2-methoxyphenyl)-1-propylpiperidine

C15H23NO — CID 12937938

IUPAC3-(2-methoxyphenyl)-1-propylpiperidine
SMILESCCCN1CCCC(c2ccccc2OC)C1
InChIInChI=1S/C15H23NO/c1-3-10-16-11-6-7-13(12-16)14-8-4-5-9-15(14)17-2/h4-5,8-9,13H,3,6-7,10-12H2,1-2H3
InChIKeyUGSUUBPXDJGUAQ-UHFFFAOYSA-N
MW233.36 g/mol
LogP3.28
Rot. Bonds4

About 3-(2-methoxyphenyl)-1-propylpiperidine

3-(2-methoxyphenyl)-1-propylpiperidine (PubChem CID 12937938) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is 3-(2-methoxyphenyl)-1-propylpiperidine.

Molecular Properties

Compound Name3-(2-methoxyphenyl)-1-propylpiperidine
PubChem CID12937938
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC Name3-(2-methoxyphenyl)-1-propylpiperidine
SMILESCCCN1CCCC(c2ccccc2OC)C1
InChIInChI=1S/C15H23NO/c1-3-10-16-11-6-7-13(12-16)14-8-4-5-9-15(14)17-2/h4-5,8-9,13H,3,6-7,10-12H2,1-2H3
InChIKeyUGSUUBPXDJGUAQ-UHFFFAOYSA-N
XLogP3.28
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyphenyl)-1-propylpiperidine?
The IUPAC name of 3-(2-methoxyphenyl)-1-propylpiperidine (CID 12937938) is 3-(2-methoxyphenyl)-1-propylpiperidine.
What is the SMILES notation for 3-(2-methoxyphenyl)-1-propylpiperidine?
The canonical SMILES for 3-(2-methoxyphenyl)-1-propylpiperidine is CCCN1CCCC(c2ccccc2OC)C1.
What is the InChIKey of 3-(2-methoxyphenyl)-1-propylpiperidine?
The InChIKey is UGSUUBPXDJGUAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-3-10-16-11-6-7-13(12-16)14-8-4-5-9-15(14)17-2/h4-5,8-9,13H,3,6-7,10-12H2,1-2H3.
What are the key properties of 3-(2-methoxyphenyl)-1-propylpiperidine?
3-(2-methoxyphenyl)-1-propylpiperidine has a molecular weight of 233.36 g/mol, XLogP of 3.28, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyphenyl)-1-propylpiperidine is sourced from PubChem (CID 12937938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).