3-(azetidin-2-ylmethoxy)-5-[2-(3-ethylphenyl)ethyl]pyridine

C19H24N2O — CID 90726650

IUPAC3-(azetidin-2-ylmethoxy)-5-[2-(3-ethylphenyl)ethyl]pyridine
SMILESCCc1cccc(CCc2cncc(OCC3CCN3)c2)c1
InChIInChI=1S/C19H24N2O/c1-2-15-4-3-5-16(10-15)6-7-17-11-19(13-20-12-17)22-14-18-8-9-21-18/h3-5,10-13,18,21H,2,6-9,14H2,1H3
InChIKeyQUNDYWAOJPTRPD-UHFFFAOYSA-N
MW296.41 g/mol
LogP3.17
Rot. Bonds7

About 3-(azetidin-2-ylmethoxy)-5-[2-(3-ethylphenyl)ethyl]pyridine

3-(azetidin-2-ylmethoxy)-5-[2-(3-ethylphenyl)ethyl]pyridine (PubChem CID 90726650) has the molecular formula C19H24N2O and a molecular weight of 296.41 g/mol. Its IUPAC name is 3-(azetidin-2-ylmethoxy)-5-[2-(3-ethylphenyl)ethyl]pyridine.

Molecular Properties

Compound Name3-(azetidin-2-ylmethoxy)-5-[2-(3-ethylphenyl)ethyl]pyridine
PubChem CID90726650
Molecular FormulaC19H24N2O
Molecular Weight296.41 g/mol
Exact Mass296.19
IUPAC Name3-(azetidin-2-ylmethoxy)-5-[2-(3-ethylphenyl)ethyl]pyridine
SMILESCCc1cccc(CCc2cncc(OCC3CCN3)c2)c1
InChIInChI=1S/C19H24N2O/c1-2-15-4-3-5-16(10-15)6-7-17-11-19(13-20-12-17)22-14-18-8-9-21-18/h3-5,10-13,18,21H,2,6-9,14H2,1H3
InChIKeyQUNDYWAOJPTRPD-UHFFFAOYSA-N
XLogP3.17
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[3-[2-[5-[[(2S)-azetidin-2-yl]methoxy]-3-pyridinyl]ethyl]phenyl]methanol;hydrochloride
CID 68611909
3-(azetidin-2-ylmethoxy)-5-pentylpyridine
CID 77323353
3-[[(2S)-azetidin-2-yl]methoxy]-5-(3-fluoropropyl)pyridine
CID 123202222
6-[2-[5-[[(2S)-azetidin-2-yl]methoxy]-3-pyridinyl]ethyl]-1,2,3,4-tetrahydroquinoline
CID 59371573
2-[3-[5-[[(2S)-azetidin-2-yl]methoxy]-3-pyridinyl]phenyl]ethanol;hydrochloride
CID 68613292
3-[[(2S)-azetidin-2-yl]methoxy]-5-[2-[(2S,5R)-5-(pyridin-3-ylmethyl)oxolan-2-yl]ethyl]pyridine
CID 59371278
3-[[(2S)-azetidin-2-yl]methoxy]-5-phenylpyridine
CID 22872635
3-[5-[5-(azetidin-2-ylmethoxy)-3-pyridinyl]-3-pyridinyl]propan-1-ol
CID 75168462
(1R)-2-[5-[[(2S)-azetidin-2-yl]methoxy]-3-pyridinyl]-1-cyclopropylethanol
CID 90893860
3-[[(2R)-azetidin-2-yl]methoxy]pyridine;dihydrochloride
CID 18391704
[(1R)-2-[[5-[[(2S)-azetidin-2-yl]methoxy]-3-pyridinyl]methyl]cycloprop-2-en-1-yl]methanol
CID 163591746
2-[5-(azetidin-2-ylmethoxy)-3-pyridinyl]-4-(2-phenylmethoxyethyl)pyridine
CID 75168438

Frequently Asked Questions

What is the IUPAC name of 3-(azetidin-2-ylmethoxy)-5-[2-(3-ethylphenyl)ethyl]pyridine?
The IUPAC name of 3-(azetidin-2-ylmethoxy)-5-[2-(3-ethylphenyl)ethyl]pyridine (CID 90726650) is 3-(azetidin-2-ylmethoxy)-5-[2-(3-ethylphenyl)ethyl]pyridine.
What is the SMILES notation for 3-(azetidin-2-ylmethoxy)-5-[2-(3-ethylphenyl)ethyl]pyridine?
The canonical SMILES for 3-(azetidin-2-ylmethoxy)-5-[2-(3-ethylphenyl)ethyl]pyridine is CCc1cccc(CCc2cncc(OCC3CCN3)c2)c1.
What is the InChIKey of 3-(azetidin-2-ylmethoxy)-5-[2-(3-ethylphenyl)ethyl]pyridine?
The InChIKey is QUNDYWAOJPTRPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O/c1-2-15-4-3-5-16(10-15)6-7-17-11-19(13-20-12-17)22-14-18-8-9-21-18/h3-5,10-13,18,21H,2,6-9,14H2,1H3.
What are the key properties of 3-(azetidin-2-ylmethoxy)-5-[2-(3-ethylphenyl)ethyl]pyridine?
3-(azetidin-2-ylmethoxy)-5-[2-(3-ethylphenyl)ethyl]pyridine has a molecular weight of 296.41 g/mol, XLogP of 3.17, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(azetidin-2-ylmethoxy)-5-[2-(3-ethylphenyl)ethyl]pyridine is sourced from PubChem (CID 90726650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).