3-(4-methoxyphenyl)-2,6-dimethyl-4-phenylmethoxypyridine

C21H21NO2 — CID 15171436

IUPAC3-(4-methoxyphenyl)-2,6-dimethyl-4-phenylmethoxypyridine
SMILESCOc1ccc(-c2c(OCc3ccccc3)cc(C)nc2C)cc1
InChIInChI=1S/C21H21NO2/c1-15-13-20(24-14-17-7-5-4-6-8-17)21(16(2)22-15)18-9-11-19(23-3)12-10-18/h4-13H,14H2,1-3H3
InChIKeyTZORKNWGDHPXMG-UHFFFAOYSA-N
MW319.40 g/mol
LogP4.95
Rot. Bonds5

About 3-(4-methoxyphenyl)-2,6-dimethyl-4-phenylmethoxypyridine

3-(4-methoxyphenyl)-2,6-dimethyl-4-phenylmethoxypyridine (PubChem CID 15171436) has the molecular formula C21H21NO2 and a molecular weight of 319.40 g/mol. Its IUPAC name is 3-(4-methoxyphenyl)-2,6-dimethyl-4-phenylmethoxypyridine.

Molecular Properties

Compound Name3-(4-methoxyphenyl)-2,6-dimethyl-4-phenylmethoxypyridine
PubChem CID15171436
Molecular FormulaC21H21NO2
Molecular Weight319.40 g/mol
Exact Mass319.16
IUPAC Name3-(4-methoxyphenyl)-2,6-dimethyl-4-phenylmethoxypyridine
SMILESCOc1ccc(-c2c(OCc3ccccc3)cc(C)nc2C)cc1
InChIInChI=1S/C21H21NO2/c1-15-13-20(24-14-17-7-5-4-6-8-17)21(16(2)22-15)18-9-11-19(23-3)12-10-18/h4-13H,14H2,1-3H3
InChIKeyTZORKNWGDHPXMG-UHFFFAOYSA-N
XLogP4.95
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.40
LogP ≤ 54.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2,6-dimethyl-4-phenylmethoxypyridine-3-carboxylic acid
CID 81053468
2,6-bis(4-methoxyphenyl)-4-(4-phenylmethoxyphenyl)pyridine
CID 132564654
1-methoxy-4-[(4-phenylmethoxyphenoxy)methyl]benzene
CID 12029541
2-(4-methoxyphenyl)-6-methyl-8-phenylmethoxyimidazo[1,2-a]pyridine
CID 71192052
azane;4-methoxy-2-methyl-1-phenylmethoxybenzene;hydrochloride
CID 174629169
2-[6-methoxy-2-(4-methoxyphenyl)-3-phenylmethoxyphenoxy]-1-benzothiophene
CID 70098532
2-amino-1-(4-methoxyphenyl)-6,7-bis(phenylmethoxy)isoquinolin-3-one
CID 44552274
2-[4-(4-methoxyphenyl)-5-methyl-1H-pyrazol-3-yl]-5-phenylmethoxyphenol
CID 2022938
6-methoxy-2-(3-methoxy-4-phenylmethoxyphenyl)-1-benzofuran
CID 57332865
6-methyl-4-phenylmethoxypyridine-2-carbonitrile
CID 130671911
2-ethynyl-4-methoxy-1-phenylmethoxybenzene
CID 154814757
3-[5-chloro-2,4-bis(phenylmethoxy)phenyl]-4-(4-methoxyphenyl)-1,2-oxazol-5-amine
CID 123307499

Frequently Asked Questions

What is the IUPAC name of 3-(4-methoxyphenyl)-2,6-dimethyl-4-phenylmethoxypyridine?
The IUPAC name of 3-(4-methoxyphenyl)-2,6-dimethyl-4-phenylmethoxypyridine (CID 15171436) is 3-(4-methoxyphenyl)-2,6-dimethyl-4-phenylmethoxypyridine.
What is the SMILES notation for 3-(4-methoxyphenyl)-2,6-dimethyl-4-phenylmethoxypyridine?
The canonical SMILES for 3-(4-methoxyphenyl)-2,6-dimethyl-4-phenylmethoxypyridine is COc1ccc(-c2c(OCc3ccccc3)cc(C)nc2C)cc1.
What is the InChIKey of 3-(4-methoxyphenyl)-2,6-dimethyl-4-phenylmethoxypyridine?
The InChIKey is TZORKNWGDHPXMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21NO2/c1-15-13-20(24-14-17-7-5-4-6-8-17)21(16(2)22-15)18-9-11-19(23-3)12-10-18/h4-13H,14H2,1-3H3.
What are the key properties of 3-(4-methoxyphenyl)-2,6-dimethyl-4-phenylmethoxypyridine?
3-(4-methoxyphenyl)-2,6-dimethyl-4-phenylmethoxypyridine has a molecular weight of 319.40 g/mol, XLogP of 4.95, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxyphenyl)-2,6-dimethyl-4-phenylmethoxypyridine is sourced from PubChem (CID 15171436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).