3-[(4-methylphenyl)methoxy]pyridine

C13H13NO — CID 58445986

IUPAC3-[(4-methylphenyl)methoxy]pyridine
SMILESCc1ccc(COc2cccnc2)cc1
InChIInChI=1S/C13H13NO/c1-11-4-6-12(7-5-11)10-15-13-3-2-8-14-9-13/h2-9H,10H2,1H3
InChIKeyHVWSATHPCGWGCW-UHFFFAOYSA-N
MW199.25 g/mol
LogP2.97
Rot. Bonds3

About 3-[(4-methylphenyl)methoxy]pyridine

3-[(4-methylphenyl)methoxy]pyridine (PubChem CID 58445986) has the molecular formula C13H13NO and a molecular weight of 199.25 g/mol. Its IUPAC name is 3-[(4-methylphenyl)methoxy]pyridine.

Molecular Properties

Compound Name3-[(4-methylphenyl)methoxy]pyridine
PubChem CID58445986
Molecular FormulaC13H13NO
Molecular Weight199.25 g/mol
Exact Mass199.10
IUPAC Name3-[(4-methylphenyl)methoxy]pyridine
SMILESCc1ccc(COc2cccnc2)cc1
InChIInChI=1S/C13H13NO/c1-11-4-6-12(7-5-11)10-15-13-3-2-8-14-9-13/h2-9H,10H2,1H3
InChIKeyHVWSATHPCGWGCW-UHFFFAOYSA-N
XLogP2.97
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 52.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-4-(pyridin-3-yloxymethyl)aniline
CID 117220552
1-methyl-4-[[4-[(4-methylphenoxy)methyl]phenoxy]methyl]benzene
CID 59641480
3-[(2,4,6-trimethylphenyl)methoxy]pyridine
CID 112558779
4-[[4-[(4-methylphenyl)methoxy]phenyl]methoxymethyl]pyridine
CID 23399976
3-[[4-(pyridin-3-ylmethoxy)phenoxy]methyl]pyridine
CID 91147542
3-(furan-3-ylmethoxy)pyridine
CID 112558860
5-[(4-methylphenyl)methoxy]-2-pyridin-3-yl-1,3-benzoxazole
CID 153469802
2-chloro-5-(pyridin-3-yloxymethyl)aniline
CID 117221990
3-[(3-fluorophenyl)methoxy]pyridine
CID 18758418
5-methyl-2-(pyridin-3-yloxymethyl)-1H-indole
CID 117185410
3-[(5-methyl-1-benzothiophen-2-yl)methoxy]pyridine
CID 117185338
3-(phenoxymethyl)pyridine;hydrochloride
CID 157085776

Frequently Asked Questions

What is the IUPAC name of 3-[(4-methylphenyl)methoxy]pyridine?
The IUPAC name of 3-[(4-methylphenyl)methoxy]pyridine (CID 58445986) is 3-[(4-methylphenyl)methoxy]pyridine.
What is the SMILES notation for 3-[(4-methylphenyl)methoxy]pyridine?
The canonical SMILES for 3-[(4-methylphenyl)methoxy]pyridine is Cc1ccc(COc2cccnc2)cc1.
What is the InChIKey of 3-[(4-methylphenyl)methoxy]pyridine?
The InChIKey is HVWSATHPCGWGCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NO/c1-11-4-6-12(7-5-11)10-15-13-3-2-8-14-9-13/h2-9H,10H2,1H3.
What are the key properties of 3-[(4-methylphenyl)methoxy]pyridine?
3-[(4-methylphenyl)methoxy]pyridine has a molecular weight of 199.25 g/mol, XLogP of 2.97, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-methylphenyl)methoxy]pyridine is sourced from PubChem (CID 58445986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).