2-[[2-(azetidin-3-yloxy)-4-chlorophenoxy]methyl]pyridine

C15H15ClN2O2 — CID 46214325

IUPAC2-[[2-(azetidin-3-yloxy)-4-chlorophenoxy]methyl]pyridine
SMILESClc1ccc(OCc2ccccn2)c(OC2CNC2)c1
InChIInChI=1S/C15H15ClN2O2/c16-11-4-5-14(15(7-11)20-13-8-17-9-13)19-10-12-3-1-2-6-18-12/h1-7,13,17H,8-10H2
InChIKeyGGVBFILEIPFMPI-UHFFFAOYSA-N
MW290.75 g/mol
LogP2.66
Rot. Bonds5

About 2-[[2-(azetidin-3-yloxy)-4-chlorophenoxy]methyl]pyridine

2-[[2-(azetidin-3-yloxy)-4-chlorophenoxy]methyl]pyridine (PubChem CID 46214325) has the molecular formula C15H15ClN2O2 and a molecular weight of 290.75 g/mol. Its IUPAC name is 2-[[2-(azetidin-3-yloxy)-4-chlorophenoxy]methyl]pyridine.

Molecular Properties

Compound Name2-[[2-(azetidin-3-yloxy)-4-chlorophenoxy]methyl]pyridine
PubChem CID46214325
Molecular FormulaC15H15ClN2O2
Molecular Weight290.75 g/mol
Exact Mass290.08
IUPAC Name2-[[2-(azetidin-3-yloxy)-4-chlorophenoxy]methyl]pyridine
SMILESClc1ccc(OCc2ccccn2)c(OC2CNC2)c1
InChIInChI=1S/C15H15ClN2O2/c16-11-4-5-14(15(7-11)20-13-8-17-9-13)19-10-12-3-1-2-6-18-12/h1-7,13,17H,8-10H2
InChIKeyGGVBFILEIPFMPI-UHFFFAOYSA-N
XLogP2.66
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.75
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 3075702
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1-[4-(4-chloro-2-methoxyphenoxy)-6-methyl-3-pyridinyl]-N,N-dimethylmethanamine
CID 25066443
1-[4-(4-chloro-2-methoxyphenoxy)-6-methyl-3-pyridinyl]-N-methylmethanamine
CID 44449298
1-[4-(4-chloro-2-methoxyphenoxy)-3-pyridinyl]-N-methylmethanamine
CID 44449332
1-[4-(4-chloro-2-ethoxyphenoxy)-3-pyridinyl]-N-methylmethanamine
CID 44449719
3-(Azetidin-3-yloxy)-2-(2-chloro-6-fluorophenoxy)pyridine
CID 53324709
US9981909, Example 82
CID 58405040
US9981909, Example 79
CID 58405047

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(azetidin-3-yloxy)-4-chlorophenoxy]methyl]pyridine?
The IUPAC name of 2-[[2-(azetidin-3-yloxy)-4-chlorophenoxy]methyl]pyridine (CID 46214325) is 2-[[2-(azetidin-3-yloxy)-4-chlorophenoxy]methyl]pyridine.
What is the SMILES notation for 2-[[2-(azetidin-3-yloxy)-4-chlorophenoxy]methyl]pyridine?
The canonical SMILES for 2-[[2-(azetidin-3-yloxy)-4-chlorophenoxy]methyl]pyridine is Clc1ccc(OCc2ccccn2)c(OC2CNC2)c1.
What is the InChIKey of 2-[[2-(azetidin-3-yloxy)-4-chlorophenoxy]methyl]pyridine?
The InChIKey is GGVBFILEIPFMPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O2/c16-11-4-5-14(15(7-11)20-13-8-17-9-13)19-10-12-3-1-2-6-18-12/h1-7,13,17H,8-10H2.
What are the key properties of 2-[[2-(azetidin-3-yloxy)-4-chlorophenoxy]methyl]pyridine?
2-[[2-(azetidin-3-yloxy)-4-chlorophenoxy]methyl]pyridine has a molecular weight of 290.75 g/mol, XLogP of 2.66, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(azetidin-3-yloxy)-4-chlorophenoxy]methyl]pyridine is sourced from PubChem (CID 46214325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).