3,6-bis(4-methoxyphenyl)-2-(4-phenylmethoxyphenyl)pyridine

C32H27NO3 — CID 18923794

IUPAC3,6-bis(4-methoxyphenyl)-2-(4-phenylmethoxyphenyl)pyridine
SMILESCOc1ccc(-c2ccc(-c3ccc(OC)cc3)c(-c3ccc(OCc4ccccc4)cc3)n2)cc1
InChIInChI=1S/C32H27NO3/c1-34-27-14-8-24(9-15-27)30-20-21-31(25-10-16-28(35-2)17-11-25)33-32(30)26-12-18-29(19-13-26)36-22-23-6-4-3-5-7-23/h3-21H,22H2,1-2H3
InChIKeyISOCRMBLPRETIP-UHFFFAOYSA-N
MW473.57 g/mol
LogP7.68
Rot. Bonds8

About 3,6-bis(4-methoxyphenyl)-2-(4-phenylmethoxyphenyl)pyridine

3,6-bis(4-methoxyphenyl)-2-(4-phenylmethoxyphenyl)pyridine (PubChem CID 18923794) has the molecular formula C32H27NO3 and a molecular weight of 473.57 g/mol. Its IUPAC name is 3,6-bis(4-methoxyphenyl)-2-(4-phenylmethoxyphenyl)pyridine.

Molecular Properties

Compound Name3,6-bis(4-methoxyphenyl)-2-(4-phenylmethoxyphenyl)pyridine
PubChem CID18923794
Molecular FormulaC32H27NO3
Molecular Weight473.57 g/mol
Exact Mass473.20
IUPAC Name3,6-bis(4-methoxyphenyl)-2-(4-phenylmethoxyphenyl)pyridine
SMILESCOc1ccc(-c2ccc(-c3ccc(OC)cc3)c(-c3ccc(OCc4ccccc4)cc3)n2)cc1
InChIInChI=1S/C32H27NO3/c1-34-27-14-8-24(9-15-27)30-20-21-31(25-10-16-28(35-2)17-11-25)33-32(30)26-12-18-29(19-13-26)36-22-23-6-4-3-5-7-23/h3-21H,22H2,1-2H3
InChIKeyISOCRMBLPRETIP-UHFFFAOYSA-N
XLogP7.68
TPSA40.58 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500473.57
LogP ≤ 57.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2,6-bis(4-methoxyphenyl)-4-(4-phenylmethoxyphenyl)pyridine
CID 132564654
1-methoxy-4-[(4-phenylmethoxyphenoxy)methyl]benzene
CID 12029541
2-bromo-4-methoxy-1-(4-phenylmethoxyphenyl)benzene
CID 91451800
2-[4-(4-methoxyphenyl)-5-methyl-1H-pyrazol-3-yl]-5-phenylmethoxyphenol
CID 2022938
3-chloro-1-(4-methoxyphenyl)-4-(4-phenylmethoxyphenyl)pyrazole
CID 141089729
5-ethenyl-2-(4-phenylmethoxyphenyl)pyridine
CID 175646915
2-methyl-4-(4-phenylmethoxyphenyl)-1,3-thiazole
CID 132533720
2-(4-phenylmethoxyphenyl)quinoxaline
CID 902798
4-(4-methoxyphenyl)-6-[1-phenyl-3-(4-phenylmethoxyphenyl)pyrazol-4-yl]-1H-pyrimidin-2-one
CID 155811971
N,N-dimethyl-1-[6-(4-phenylmethoxyphenyl)-2-pyridinyl]pentan-1-amine
CID 70645341
N-hydroxy-6-(4-phenylmethoxyphenyl)pyridine-2-carboxamide
CID 87562744
4-(2-methoxy-3-pyridinyl)-5-(4-phenylmethoxyphenyl)-2-propan-2-yl-1,3-oxazole
CID 154455192

Frequently Asked Questions

What is the IUPAC name of 3,6-bis(4-methoxyphenyl)-2-(4-phenylmethoxyphenyl)pyridine?
The IUPAC name of 3,6-bis(4-methoxyphenyl)-2-(4-phenylmethoxyphenyl)pyridine (CID 18923794) is 3,6-bis(4-methoxyphenyl)-2-(4-phenylmethoxyphenyl)pyridine.
What is the SMILES notation for 3,6-bis(4-methoxyphenyl)-2-(4-phenylmethoxyphenyl)pyridine?
The canonical SMILES for 3,6-bis(4-methoxyphenyl)-2-(4-phenylmethoxyphenyl)pyridine is COc1ccc(-c2ccc(-c3ccc(OC)cc3)c(-c3ccc(OCc4ccccc4)cc3)n2)cc1.
What is the InChIKey of 3,6-bis(4-methoxyphenyl)-2-(4-phenylmethoxyphenyl)pyridine?
The InChIKey is ISOCRMBLPRETIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H27NO3/c1-34-27-14-8-24(9-15-27)30-20-21-31(25-10-16-28(35-2)17-11-25)33-32(30)26-12-18-29(19-13-26)36-22-23-6-4-3-5-7-23/h3-21H,22H2,1-2H3.
What are the key properties of 3,6-bis(4-methoxyphenyl)-2-(4-phenylmethoxyphenyl)pyridine?
3,6-bis(4-methoxyphenyl)-2-(4-phenylmethoxyphenyl)pyridine has a molecular weight of 473.57 g/mol, XLogP of 7.68, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-bis(4-methoxyphenyl)-2-(4-phenylmethoxyphenyl)pyridine is sourced from PubChem (CID 18923794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).