6-(2,6-dimethoxyphenyl)-2,4-dimethyl-3-phenylpyridine

C21H21NO2 — CID 122206647

IUPAC6-(2,6-dimethoxyphenyl)-2,4-dimethyl-3-phenylpyridine
SMILESCOc1cccc(OC)c1-c1cc(C)c(-c2ccccc2)c(C)n1
InChIInChI=1S/C21H21NO2/c1-14-13-17(21-18(23-3)11-8-12-19(21)24-4)22-15(2)20(14)16-9-6-5-7-10-16/h5-13H,1-4H3
InChIKeyFGTRURQLBFWHKZ-UHFFFAOYSA-N
MW319.40 g/mol
LogP5.05
Rot. Bonds4

About 6-(2,6-dimethoxyphenyl)-2,4-dimethyl-3-phenylpyridine

6-(2,6-dimethoxyphenyl)-2,4-dimethyl-3-phenylpyridine (PubChem CID 122206647) has the molecular formula C21H21NO2 and a molecular weight of 319.40 g/mol. Its IUPAC name is 6-(2,6-dimethoxyphenyl)-2,4-dimethyl-3-phenylpyridine.

Molecular Properties

Compound Name6-(2,6-dimethoxyphenyl)-2,4-dimethyl-3-phenylpyridine
PubChem CID122206647
Molecular FormulaC21H21NO2
Molecular Weight319.40 g/mol
Exact Mass319.16
IUPAC Name6-(2,6-dimethoxyphenyl)-2,4-dimethyl-3-phenylpyridine
SMILESCOc1cccc(OC)c1-c1cc(C)c(-c2ccccc2)c(C)n1
InChIInChI=1S/C21H21NO2/c1-14-13-17(21-18(23-3)11-8-12-19(21)24-4)22-15(2)20(14)16-9-6-5-7-10-16/h5-13H,1-4H3
InChIKeyFGTRURQLBFWHKZ-UHFFFAOYSA-N
XLogP5.05
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500319.40
LogP ≤ 55.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1,3-dimethoxy-2-phenylbenzene;hydrochloride
CID 175871248
2-chloro-4-(2,6-dimethoxyphenyl)-6-methylpyrimidine
CID 116811184
2-(2-fluoro-6-methoxyphenyl)-6,7-dimethoxy-4-methylquinoline
CID 169418540
8-methoxy-3-methyl-4-phenylnaphthalen-1-ol
CID 101420154
3-(3,4-dimethoxyphenyl)-6,7-dimethoxy-1-methyl-4-phenylisoquinoline
CID 11418585
N-[2-(2,6-dimethoxyphenyl)-4-methylquinolin-6-yl]methanesulfonamide
CID 169411496
6-cyclohexyl-2,4-dimethyl-3-phenylpyridine
CID 122206650
5-(2-methoxyphenyl)-3-methyl-2-phenylpyrazine
CID 68842522
8-methoxy-1-methyl-3-phenylisoquinolin-4-amine
CID 122424753
2,4-dichloro-8-methoxy-3-phenylquinoline
CID 2780585
2-(2,6-difluorophenyl)-6,7-dimethoxy-4-methylquinoline
CID 169417094
6,7-dimethoxy-2,3-diphenylquinoxaline
CID 1236458

Frequently Asked Questions

What is the IUPAC name of 6-(2,6-dimethoxyphenyl)-2,4-dimethyl-3-phenylpyridine?
The IUPAC name of 6-(2,6-dimethoxyphenyl)-2,4-dimethyl-3-phenylpyridine (CID 122206647) is 6-(2,6-dimethoxyphenyl)-2,4-dimethyl-3-phenylpyridine.
What is the SMILES notation for 6-(2,6-dimethoxyphenyl)-2,4-dimethyl-3-phenylpyridine?
The canonical SMILES for 6-(2,6-dimethoxyphenyl)-2,4-dimethyl-3-phenylpyridine is COc1cccc(OC)c1-c1cc(C)c(-c2ccccc2)c(C)n1.
What is the InChIKey of 6-(2,6-dimethoxyphenyl)-2,4-dimethyl-3-phenylpyridine?
The InChIKey is FGTRURQLBFWHKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21NO2/c1-14-13-17(21-18(23-3)11-8-12-19(21)24-4)22-15(2)20(14)16-9-6-5-7-10-16/h5-13H,1-4H3.
What are the key properties of 6-(2,6-dimethoxyphenyl)-2,4-dimethyl-3-phenylpyridine?
6-(2,6-dimethoxyphenyl)-2,4-dimethyl-3-phenylpyridine has a molecular weight of 319.40 g/mol, XLogP of 5.05, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,6-dimethoxyphenyl)-2,4-dimethyl-3-phenylpyridine is sourced from PubChem (CID 122206647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).