3-(3-methoxyphenyl)-6-[5-(3-methoxyphenyl)-6-methyl-2-pyridinyl]-2-methylpyridine

C26H24N2O2 — CID 101485058

IUPAC3-(3-methoxyphenyl)-6-[5-(3-methoxyphenyl)-6-methyl-2-pyridinyl]-2-methylpyridine
SMILESCOc1cccc(-c2ccc(-c3ccc(-c4cccc(OC)c4)c(C)n3)nc2C)c1
InChIInChI=1S/C26H24N2O2/c1-17-23(19-7-5-9-21(15-19)29-3)11-13-25(27-17)26-14-12-24(18(2)28-26)20-8-6-10-22(16-20)30-4/h5-16H,1-4H3
InChIKeyBYSXMSNKUWRYSL-UHFFFAOYSA-N
MW396.49 g/mol
LogP6.11
Rot. Bonds5

About 3-(3-methoxyphenyl)-6-[5-(3-methoxyphenyl)-6-methyl-2-pyridinyl]-2-methylpyridine

3-(3-methoxyphenyl)-6-[5-(3-methoxyphenyl)-6-methyl-2-pyridinyl]-2-methylpyridine (PubChem CID 101485058) has the molecular formula C26H24N2O2 and a molecular weight of 396.49 g/mol. Its IUPAC name is 3-(3-methoxyphenyl)-6-[5-(3-methoxyphenyl)-6-methyl-2-pyridinyl]-2-methylpyridine.

Molecular Properties

Compound Name3-(3-methoxyphenyl)-6-[5-(3-methoxyphenyl)-6-methyl-2-pyridinyl]-2-methylpyridine
PubChem CID101485058
Molecular FormulaC26H24N2O2
Molecular Weight396.49 g/mol
Exact Mass396.18
IUPAC Name3-(3-methoxyphenyl)-6-[5-(3-methoxyphenyl)-6-methyl-2-pyridinyl]-2-methylpyridine
SMILESCOc1cccc(-c2ccc(-c3ccc(-c4cccc(OC)c4)c(C)n3)nc2C)c1
InChIInChI=1S/C26H24N2O2/c1-17-23(19-7-5-9-21(15-19)29-3)11-13-25(27-17)26-14-12-24(18(2)28-26)20-8-6-10-22(16-20)30-4/h5-16H,1-4H3
InChIKeyBYSXMSNKUWRYSL-UHFFFAOYSA-N
XLogP6.11
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms30
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500396.49
LogP ≤ 56.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(3-methoxyphenyl)-6-[5-(3-methoxyphenyl)-6-methyl-2-pyridinyl]-2-methylpyridine?
The IUPAC name of 3-(3-methoxyphenyl)-6-[5-(3-methoxyphenyl)-6-methyl-2-pyridinyl]-2-methylpyridine (CID 101485058) is 3-(3-methoxyphenyl)-6-[5-(3-methoxyphenyl)-6-methyl-2-pyridinyl]-2-methylpyridine.
What is the SMILES notation for 3-(3-methoxyphenyl)-6-[5-(3-methoxyphenyl)-6-methyl-2-pyridinyl]-2-methylpyridine?
The canonical SMILES for 3-(3-methoxyphenyl)-6-[5-(3-methoxyphenyl)-6-methyl-2-pyridinyl]-2-methylpyridine is COc1cccc(-c2ccc(-c3ccc(-c4cccc(OC)c4)c(C)n3)nc2C)c1.
What is the InChIKey of 3-(3-methoxyphenyl)-6-[5-(3-methoxyphenyl)-6-methyl-2-pyridinyl]-2-methylpyridine?
The InChIKey is BYSXMSNKUWRYSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24N2O2/c1-17-23(19-7-5-9-21(15-19)29-3)11-13-25(27-17)26-14-12-24(18(2)28-26)20-8-6-10-22(16-20)30-4/h5-16H,1-4H3.
What are the key properties of 3-(3-methoxyphenyl)-6-[5-(3-methoxyphenyl)-6-methyl-2-pyridinyl]-2-methylpyridine?
3-(3-methoxyphenyl)-6-[5-(3-methoxyphenyl)-6-methyl-2-pyridinyl]-2-methylpyridine has a molecular weight of 396.49 g/mol, XLogP of 6.11, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methoxyphenyl)-6-[5-(3-methoxyphenyl)-6-methyl-2-pyridinyl]-2-methylpyridine is sourced from PubChem (CID 101485058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).