4-(methoxymethyl)-1-[3-(3-methoxyphenyl)propyl]piperidine

C17H27NO2 — CID 71999972

IUPAC4-(methoxymethyl)-1-[3-(3-methoxyphenyl)propyl]piperidine
SMILESCOCC1CCN(CCCc2cccc(OC)c2)CC1
InChIInChI=1S/C17H27NO2/c1-19-14-16-8-11-18(12-9-16)10-4-6-15-5-3-7-17(13-15)20-2/h3,5,7,13,16H,4,6,8-12,14H2,1-2H3
InChIKeyHGLOGFXQHVXLOI-UHFFFAOYSA-N
MW277.41 g/mol
LogP2.99
Rot. Bonds7

About 4-(methoxymethyl)-1-[3-(3-methoxyphenyl)propyl]piperidine

4-(methoxymethyl)-1-[3-(3-methoxyphenyl)propyl]piperidine (PubChem CID 71999972) has the molecular formula C17H27NO2 and a molecular weight of 277.41 g/mol. Its IUPAC name is 4-(methoxymethyl)-1-[3-(3-methoxyphenyl)propyl]piperidine.

Molecular Properties

Compound Name4-(methoxymethyl)-1-[3-(3-methoxyphenyl)propyl]piperidine
PubChem CID71999972
Molecular FormulaC17H27NO2
Molecular Weight277.41 g/mol
Exact Mass277.20
IUPAC Name4-(methoxymethyl)-1-[3-(3-methoxyphenyl)propyl]piperidine
SMILESCOCC1CCN(CCCc2cccc(OC)c2)CC1
InChIInChI=1S/C17H27NO2/c1-19-14-16-8-11-18(12-9-16)10-4-6-15-5-3-7-17(13-15)20-2/h3,5,7,13,16H,4,6,8-12,14H2,1-2H3
InChIKeyHGLOGFXQHVXLOI-UHFFFAOYSA-N
XLogP2.99
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 52.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-[3-(3-methoxyphenyl)propyl]-4-methylpiperazine
CID 170862318
4-[3-(3-methoxyphenyl)propyl]morpholine
CID 91901626
1-[2-(3-methoxyphenyl)ethyl]piperidin-4-ol
CID 82083424
cyclopropyl-[4-[3-(3-methoxyphenyl)propyl]piperazin-1-yl]methanone
CID 110358229
1-[2-(3-methoxyphenyl)ethyl]-4-[2-(4-methoxyphenyl)ethyl]piperidine;hydrochloride
CID 127043453
1-[4-(3-methoxyphenyl)butyl]piperazine
CID 94267853
1-[2-(3-methoxyphenyl)ethyl]pyrrolidin-3-amine
CID 82158725
1-[4-[3-(3-methoxyphenyl)propyl]piperazin-1-yl]propan-1-one
CID 110358226
3-[3-(4-ethylpiperidin-1-yl)propyl]aniline
CID 113290630
1-[2-(3-methoxyphenyl)ethyl]-N-propylpiperidin-4-amine
CID 107852949
1-(1-benzofuran-2-ylmethyl)-4-[3-(3-methoxyphenyl)propyl]piperazine
CID 56678761
1-[2-[(4-chlorophenyl)methoxy]ethyl]-4-[3-(3-methoxyphenyl)propyl]piperazine;dihydrochloride
CID 19102671

Frequently Asked Questions

What is the IUPAC name of 4-(methoxymethyl)-1-[3-(3-methoxyphenyl)propyl]piperidine?
The IUPAC name of 4-(methoxymethyl)-1-[3-(3-methoxyphenyl)propyl]piperidine (CID 71999972) is 4-(methoxymethyl)-1-[3-(3-methoxyphenyl)propyl]piperidine.
What is the SMILES notation for 4-(methoxymethyl)-1-[3-(3-methoxyphenyl)propyl]piperidine?
The canonical SMILES for 4-(methoxymethyl)-1-[3-(3-methoxyphenyl)propyl]piperidine is COCC1CCN(CCCc2cccc(OC)c2)CC1.
What is the InChIKey of 4-(methoxymethyl)-1-[3-(3-methoxyphenyl)propyl]piperidine?
The InChIKey is HGLOGFXQHVXLOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27NO2/c1-19-14-16-8-11-18(12-9-16)10-4-6-15-5-3-7-17(13-15)20-2/h3,5,7,13,16H,4,6,8-12,14H2,1-2H3.
What are the key properties of 4-(methoxymethyl)-1-[3-(3-methoxyphenyl)propyl]piperidine?
4-(methoxymethyl)-1-[3-(3-methoxyphenyl)propyl]piperidine has a molecular weight of 277.41 g/mol, XLogP of 2.99, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methoxymethyl)-1-[3-(3-methoxyphenyl)propyl]piperidine is sourced from PubChem (CID 71999972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).