4-[1-[2-(4-methoxyphenoxy)ethyl]piperidin-4-yl]pyridine

C19H24N2O2 — CID 50950194

IUPAC4-[1-[2-(4-methoxyphenoxy)ethyl]piperidin-4-yl]pyridine
SMILESCOc1ccc(OCCN2CCC(c3ccncc3)CC2)cc1
InChIInChI=1S/C19H24N2O2/c1-22-18-2-4-19(5-3-18)23-15-14-21-12-8-17(9-13-21)16-6-10-20-11-7-16/h2-7,10-11,17H,8-9,12-15H2,1H3
InChIKeyQICVTGQJDGXJAY-UHFFFAOYSA-N
MW312.41 g/mol
LogP3.35
Rot. Bonds6

About 4-[1-[2-(4-methoxyphenoxy)ethyl]piperidin-4-yl]pyridine

4-[1-[2-(4-methoxyphenoxy)ethyl]piperidin-4-yl]pyridine (PubChem CID 50950194) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is 4-[1-[2-(4-methoxyphenoxy)ethyl]piperidin-4-yl]pyridine.

Molecular Properties

Compound Name4-[1-[2-(4-methoxyphenoxy)ethyl]piperidin-4-yl]pyridine
PubChem CID50950194
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC Name4-[1-[2-(4-methoxyphenoxy)ethyl]piperidin-4-yl]pyridine
SMILESCOc1ccc(OCCN2CCC(c3ccncc3)CC2)cc1
InChIInChI=1S/C19H24N2O2/c1-22-18-2-4-19(5-3-18)23-15-14-21-12-8-17(9-13-21)16-6-10-20-11-7-16/h2-7,10-11,17H,8-9,12-15H2,1H3
InChIKeyQICVTGQJDGXJAY-UHFFFAOYSA-N
XLogP3.35
TPSA34.59 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 53.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-[2-[(3R)-3-(4-methoxyphenyl)pyrrolidin-1-yl]ethyl]pyridine
CID 124591492
[1-[2-(4-methoxyphenoxy)ethyl]piperidin-4-yl]methanol
CID 60768510
cyclopropyl-[4-[3-(4-pyridin-4-ylpiperidin-1-yl)propoxy]phenyl]methanone
CID 162643335
[4-[2-(4-methoxyphenoxy)ethyl]piperazin-1-yl]-pyridin-4-ylmethanone
CID 27846376
1-[2-(4-methoxyphenoxy)ethyl]azepane
CID 888209
4-(4-butoxyphenyl)-1-propylpiperidine
CID 57387305
3-[1-[3-(6-methoxynaphthalen-2-yl)oxypropyl]piperidin-4-yl]pyridine
CID 21198085
3-[4-(4-methoxyphenyl)piperidin-1-yl]propan-1-amine
CID 94689546
4-[1-[(4-pyridin-4-ylpiperidin-1-yl)methyl]piperidin-4-yl]pyridine
CID 59705532
3-(bromomethyl)-1-[2-(4-methoxyphenoxy)ethyl]pyrrolidine
CID 80691311
1-[2-[2-[4-(4-methoxyphenyl)piperidin-1-yl]ethoxy]ethyl]benzimidazole
CID 139918390
1-[2-(4-fluorophenoxy)ethyl]-4-[(4-methoxyphenyl)methyl]piperidine;hydrochloride
CID 23294491

Frequently Asked Questions

What is the IUPAC name of 4-[1-[2-(4-methoxyphenoxy)ethyl]piperidin-4-yl]pyridine?
The IUPAC name of 4-[1-[2-(4-methoxyphenoxy)ethyl]piperidin-4-yl]pyridine (CID 50950194) is 4-[1-[2-(4-methoxyphenoxy)ethyl]piperidin-4-yl]pyridine.
What is the SMILES notation for 4-[1-[2-(4-methoxyphenoxy)ethyl]piperidin-4-yl]pyridine?
The canonical SMILES for 4-[1-[2-(4-methoxyphenoxy)ethyl]piperidin-4-yl]pyridine is COc1ccc(OCCN2CCC(c3ccncc3)CC2)cc1.
What is the InChIKey of 4-[1-[2-(4-methoxyphenoxy)ethyl]piperidin-4-yl]pyridine?
The InChIKey is QICVTGQJDGXJAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-22-18-2-4-19(5-3-18)23-15-14-21-12-8-17(9-13-21)16-6-10-20-11-7-16/h2-7,10-11,17H,8-9,12-15H2,1H3.
What are the key properties of 4-[1-[2-(4-methoxyphenoxy)ethyl]piperidin-4-yl]pyridine?
4-[1-[2-(4-methoxyphenoxy)ethyl]piperidin-4-yl]pyridine has a molecular weight of 312.41 g/mol, XLogP of 3.35, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-[2-(4-methoxyphenoxy)ethyl]piperidin-4-yl]pyridine is sourced from PubChem (CID 50950194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).