4-[2-methoxy-5-(oxolan-3-yl)phenyl]piperidine

C16H23NO2 — CID 117408137

IUPAC4-[2-methoxy-5-(oxolan-3-yl)phenyl]piperidine
SMILESCOc1ccc(C2CCOC2)cc1C1CCNCC1
InChIInChI=1S/C16H23NO2/c1-18-16-3-2-13(14-6-9-19-11-14)10-15(16)12-4-7-17-8-5-12/h2-3,10,12,14,17H,4-9,11H2,1H3
InChIKeyQOTDGOPGOYDEKA-UHFFFAOYSA-N
MW261.36 g/mol
LogP2.67
Rot. Bonds3

About 4-[2-methoxy-5-(oxolan-3-yl)phenyl]piperidine

4-[2-methoxy-5-(oxolan-3-yl)phenyl]piperidine (PubChem CID 117408137) has the molecular formula C16H23NO2 and a molecular weight of 261.36 g/mol. Its IUPAC name is 4-[2-methoxy-5-(oxolan-3-yl)phenyl]piperidine.

Molecular Properties

Compound Name4-[2-methoxy-5-(oxolan-3-yl)phenyl]piperidine
PubChem CID117408137
Molecular FormulaC16H23NO2
Molecular Weight261.36 g/mol
Exact Mass261.17
IUPAC Name4-[2-methoxy-5-(oxolan-3-yl)phenyl]piperidine
SMILESCOc1ccc(C2CCOC2)cc1C1CCNCC1
InChIInChI=1S/C16H23NO2/c1-18-16-3-2-13(14-6-9-19-11-14)10-15(16)12-4-7-17-8-5-12/h2-3,10,12,14,17H,4-9,11H2,1H3
InChIKeyQOTDGOPGOYDEKA-UHFFFAOYSA-N
XLogP2.67
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.36
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[[2-methoxy-5-(oxan-4-yl)phenyl]methyl]piperidine
CID 117467793
4-methoxy-3-piperidin-4-ylbenzaldehyde
CID 166844972
4-(2-methoxyphenyl)piperidine
CID 544738
2-(3-cyclohexyl-4-methoxyphenyl)morpholine
CID 117440824
methyl 4-methoxy-3-piperidin-4-ylbenzoate
CID 139793069
4-(5-tert-butyl-2-methoxyphenyl)azepane
CID 82302415
4-[5-(2,2-dimethylpropyl)-2-methoxyphenyl]piperidine
CID 117408603
4-[3-chloro-4-(oxolan-3-yloxy)phenyl]piperidine
CID 117452446
1-[2-methoxy-5-(oxolan-3-yl)phenyl]-2-(methylamino)ethanone
CID 117376242
4-(2-methoxyphenyl)oxane
CID 121009799
2-(oxolan-3-yloxy)-4-piperidin-4-ylaniline
CID 164888733
4-[[3-methoxy-4-(oxolan-3-yloxy)phenyl]methyl]piperidine
CID 117470870

Frequently Asked Questions

What is the IUPAC name of 4-[2-methoxy-5-(oxolan-3-yl)phenyl]piperidine?
The IUPAC name of 4-[2-methoxy-5-(oxolan-3-yl)phenyl]piperidine (CID 117408137) is 4-[2-methoxy-5-(oxolan-3-yl)phenyl]piperidine.
What is the SMILES notation for 4-[2-methoxy-5-(oxolan-3-yl)phenyl]piperidine?
The canonical SMILES for 4-[2-methoxy-5-(oxolan-3-yl)phenyl]piperidine is COc1ccc(C2CCOC2)cc1C1CCNCC1.
What is the InChIKey of 4-[2-methoxy-5-(oxolan-3-yl)phenyl]piperidine?
The InChIKey is QOTDGOPGOYDEKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO2/c1-18-16-3-2-13(14-6-9-19-11-14)10-15(16)12-4-7-17-8-5-12/h2-3,10,12,14,17H,4-9,11H2,1H3.
What are the key properties of 4-[2-methoxy-5-(oxolan-3-yl)phenyl]piperidine?
4-[2-methoxy-5-(oxolan-3-yl)phenyl]piperidine has a molecular weight of 261.36 g/mol, XLogP of 2.67, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-methoxy-5-(oxolan-3-yl)phenyl]piperidine is sourced from PubChem (CID 117408137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).