3-chloro-5-[(4-methoxyphenyl)methoxy]pyridine

C13H12ClNO2 — CID 22607567

IUPAC3-chloro-5-[(4-methoxyphenyl)methoxy]pyridine
SMILESCOc1ccc(COc2cncc(Cl)c2)cc1
InChIInChI=1S/C13H12ClNO2/c1-16-12-4-2-10(3-5-12)9-17-13-6-11(14)7-15-8-13/h2-8H,9H2,1H3
InChIKeyLZEDAHOLDLSSMO-UHFFFAOYSA-N
MW249.70 g/mol
LogP3.32
Rot. Bonds4

About 3-chloro-5-[(4-methoxyphenyl)methoxy]pyridine

3-chloro-5-[(4-methoxyphenyl)methoxy]pyridine (PubChem CID 22607567) has the molecular formula C13H12ClNO2 and a molecular weight of 249.70 g/mol. Its IUPAC name is 3-chloro-5-[(4-methoxyphenyl)methoxy]pyridine.

Molecular Properties

Compound Name3-chloro-5-[(4-methoxyphenyl)methoxy]pyridine
PubChem CID22607567
Molecular FormulaC13H12ClNO2
Molecular Weight249.70 g/mol
Exact Mass249.06
IUPAC Name3-chloro-5-[(4-methoxyphenyl)methoxy]pyridine
SMILESCOc1ccc(COc2cncc(Cl)c2)cc1
InChIInChI=1S/C13H12ClNO2/c1-16-12-4-2-10(3-5-12)9-17-13-6-11(14)7-15-8-13/h2-8H,9H2,1H3
InChIKeyLZEDAHOLDLSSMO-UHFFFAOYSA-N
XLogP3.32
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.70
LogP ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(5-chloro-3-pyridinyl)oxymethyl]benzonitrile
CID 64601565
5-[(4-methoxyphenyl)methoxy]pyridine-3-carbaldehyde
CID 113469448
4-[(5-chloro-3-pyridinyl)oxymethyl]benzenecarboximidamide
CID 64602735
4-[(4-methoxyphenyl)methoxy]pyridine
CID 54365889
4-[(5-chloro-3-pyridinyl)oxymethyl]-N-methylpyridin-2-amine
CID 64601208
2-[(5-chloro-3-pyridinyl)oxy]-5-(4-methoxyphenyl)pyrimidine
CID 3656433
4-[(5-chloro-3-pyridinyl)oxymethyl]-2-fluorobenzoic acid
CID 106698444
5-[(4-chlorophenyl)methoxy]-N-ethylpyridin-3-amine
CID 104536863
2-chloro-4-[(4-methoxyphenyl)methoxy]aniline
CID 62113615
1-chloro-3-[(4-methoxyphenoxy)methyl]benzene
CID 112788879
3-chloro-5-[(4-methoxyphenyl)methoxy]pyridine-4-carbaldehyde
CID 22607272
1-methoxy-4-[(4-phenylmethoxyphenoxy)methyl]benzene
CID 12029541

Frequently Asked Questions

What is the IUPAC name of 3-chloro-5-[(4-methoxyphenyl)methoxy]pyridine?
The IUPAC name of 3-chloro-5-[(4-methoxyphenyl)methoxy]pyridine (CID 22607567) is 3-chloro-5-[(4-methoxyphenyl)methoxy]pyridine.
What is the SMILES notation for 3-chloro-5-[(4-methoxyphenyl)methoxy]pyridine?
The canonical SMILES for 3-chloro-5-[(4-methoxyphenyl)methoxy]pyridine is COc1ccc(COc2cncc(Cl)c2)cc1.
What is the InChIKey of 3-chloro-5-[(4-methoxyphenyl)methoxy]pyridine?
The InChIKey is LZEDAHOLDLSSMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12ClNO2/c1-16-12-4-2-10(3-5-12)9-17-13-6-11(14)7-15-8-13/h2-8H,9H2,1H3.
What are the key properties of 3-chloro-5-[(4-methoxyphenyl)methoxy]pyridine?
3-chloro-5-[(4-methoxyphenyl)methoxy]pyridine has a molecular weight of 249.70 g/mol, XLogP of 3.32, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-5-[(4-methoxyphenyl)methoxy]pyridine is sourced from PubChem (CID 22607567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).