4-(2-methoxy-4-prop-2-enylphenoxy)piperidine

C15H21NO2 — CID 56830913

IUPAC4-(2-methoxy-4-prop-2-enylphenoxy)piperidine
SMILESC=CCc1ccc(OC2CCNCC2)c(OC)c1
InChIInChI=1S/C15H21NO2/c1-3-4-12-5-6-14(15(11-12)17-2)18-13-7-9-16-10-8-13/h3,5-6,11,13,16H,1,4,7-10H2,2H3
InChIKeyVSGOVNPRJNZPPN-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.55
Rot. Bonds5

About 4-(2-methoxy-4-prop-2-enylphenoxy)piperidine

4-(2-methoxy-4-prop-2-enylphenoxy)piperidine (PubChem CID 56830913) has the molecular formula C15H21NO2 and a molecular weight of 247.34 g/mol. Its IUPAC name is 4-(2-methoxy-4-prop-2-enylphenoxy)piperidine.

Molecular Properties

Compound Name4-(2-methoxy-4-prop-2-enylphenoxy)piperidine
PubChem CID56830913
Molecular FormulaC15H21NO2
Molecular Weight247.34 g/mol
Exact Mass247.16
IUPAC Name4-(2-methoxy-4-prop-2-enylphenoxy)piperidine
SMILESC=CCc1ccc(OC2CCNCC2)c(OC)c1
InChIInChI=1S/C15H21NO2/c1-3-4-12-5-6-14(15(11-12)17-2)18-13-7-9-16-10-8-13/h3,5-6,11,13,16H,1,4,7-10H2,2H3
InChIKeyVSGOVNPRJNZPPN-UHFFFAOYSA-N
XLogP2.55
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

4-(2-methoxy-4-propylphenoxy)piperidine;hydrochloride
CID 56831182
1,2-dimethoxy-4-prop-2-enylbenzene;ethane
CID 143927430
3-[2-(2-methoxy-4-prop-2-enylphenoxy)ethyl]pyrrolidine
CID 167890113
(3R)-3-(4-ethyl-2-methoxyphenoxy)pyrrolidine
CID 107664998
[3-methoxy-4-[(3S)-pyrrolidin-3-yl]oxyphenyl]methanol
CID 107743165
2-methoxy-1-[6-(2-methoxy-4-prop-2-enylphenoxy)hexoxy]-4-prop-2-enylbenzene
CID 19906474
(2-methoxy-4-prop-2-enylphenoxy)phosphane
CID 155424724
4-[[3-methoxy-4-(oxolan-3-yloxy)phenyl]methyl]piperidine
CID 117470870
(2-methoxy-4-prop-2-enylphenyl) (2S)-pyrrolidine-2-carboxylate
CID 142526411
2-methoxy-1-propan-2-yloxy-4-prop-2-enylbenzene
CID 57350376
(2-methoxy-4-prop-2-enylphenyl) formate
CID 24835
1,2-dimethoxy-3-(2-methoxy-4-prop-2-enylphenoxy)-5-prop-2-enylbenzene
CID 122178034

Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxy-4-prop-2-enylphenoxy)piperidine?
The IUPAC name of 4-(2-methoxy-4-prop-2-enylphenoxy)piperidine (CID 56830913) is 4-(2-methoxy-4-prop-2-enylphenoxy)piperidine.
What is the SMILES notation for 4-(2-methoxy-4-prop-2-enylphenoxy)piperidine?
The canonical SMILES for 4-(2-methoxy-4-prop-2-enylphenoxy)piperidine is C=CCc1ccc(OC2CCNCC2)c(OC)c1.
What is the InChIKey of 4-(2-methoxy-4-prop-2-enylphenoxy)piperidine?
The InChIKey is VSGOVNPRJNZPPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO2/c1-3-4-12-5-6-14(15(11-12)17-2)18-13-7-9-16-10-8-13/h3,5-6,11,13,16H,1,4,7-10H2,2H3.
What are the key properties of 4-(2-methoxy-4-prop-2-enylphenoxy)piperidine?
4-(2-methoxy-4-prop-2-enylphenoxy)piperidine has a molecular weight of 247.34 g/mol, XLogP of 2.55, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxy-4-prop-2-enylphenoxy)piperidine is sourced from PubChem (CID 56830913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).