1-(3-methoxyphenyl)piperidine

C12H17NO — CID 605725

IUPAC1-(3-methoxyphenyl)piperidine
SMILESCOc1cccc(N2CCCCC2)c1
InChIInChI=1S/C12H17NO/c1-14-12-7-5-6-11(10-12)13-8-3-2-4-9-13/h5-7,10H,2-4,8-9H2,1H3
InChIKeyGZGYOLIWTUXMAR-UHFFFAOYSA-N
MW191.27 g/mol
LogP2.69
Rot. Bonds2

About 1-(3-methoxyphenyl)piperidine

1-(3-methoxyphenyl)piperidine (PubChem CID 605725) has the molecular formula C12H17NO and a molecular weight of 191.27 g/mol. Its IUPAC name is 1-(3-methoxyphenyl)piperidine.

Molecular Properties

Compound Name1-(3-methoxyphenyl)piperidine
PubChem CID605725
Molecular FormulaC12H17NO
Molecular Weight191.27 g/mol
Exact Mass191.13
IUPAC Name1-(3-methoxyphenyl)piperidine
SMILESCOc1cccc(N2CCCCC2)c1
InChIInChI=1S/C12H17NO/c1-14-12-7-5-6-11(10-12)13-8-3-2-4-9-13/h5-7,10H,2-4,8-9H2,1H3
InChIKeyGZGYOLIWTUXMAR-UHFFFAOYSA-N
XLogP2.69
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxyphenyl)piperidine?
The IUPAC name of 1-(3-methoxyphenyl)piperidine (CID 605725) is 1-(3-methoxyphenyl)piperidine.
What is the SMILES notation for 1-(3-methoxyphenyl)piperidine?
The canonical SMILES for 1-(3-methoxyphenyl)piperidine is COc1cccc(N2CCCCC2)c1.
What is the InChIKey of 1-(3-methoxyphenyl)piperidine?
The InChIKey is GZGYOLIWTUXMAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO/c1-14-12-7-5-6-11(10-12)13-8-3-2-4-9-13/h5-7,10H,2-4,8-9H2,1H3.
What are the key properties of 1-(3-methoxyphenyl)piperidine?
1-(3-methoxyphenyl)piperidine has a molecular weight of 191.27 g/mol, XLogP of 2.69, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxyphenyl)piperidine is sourced from PubChem (CID 605725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).