2-methoxy-6-[6-(3,4,5-trimethoxyphenyl)-2-pyridinyl]phenol

C21H21NO5 — CID 136502284

IUPAC2-methoxy-6-[6-(3,4,5-trimethoxyphenyl)-2-pyridinyl]phenol
SMILESCOc1cccc(-c2cccc(-c3cc(OC)c(OC)c(OC)c3)n2)c1O
InChIInChI=1S/C21H21NO5/c1-24-17-10-5-7-14(20(17)23)16-9-6-8-15(22-16)13-11-18(25-2)21(27-4)19(12-13)26-3/h5-12,23H,1-4H3
InChIKeyKQBMYUNYMDGESD-UHFFFAOYSA-N
MW367.40 g/mol
LogP4.16
Rot. Bonds6

About 2-methoxy-6-[6-(3,4,5-trimethoxyphenyl)-2-pyridinyl]phenol

2-methoxy-6-[6-(3,4,5-trimethoxyphenyl)-2-pyridinyl]phenol (PubChem CID 136502284) has the molecular formula C21H21NO5 and a molecular weight of 367.40 g/mol. Its IUPAC name is 2-methoxy-6-[6-(3,4,5-trimethoxyphenyl)-2-pyridinyl]phenol.

Molecular Properties

Compound Name2-methoxy-6-[6-(3,4,5-trimethoxyphenyl)-2-pyridinyl]phenol
PubChem CID136502284
Molecular FormulaC21H21NO5
Molecular Weight367.40 g/mol
Exact Mass367.14
IUPAC Name2-methoxy-6-[6-(3,4,5-trimethoxyphenyl)-2-pyridinyl]phenol
SMILESCOc1cccc(-c2cccc(-c3cc(OC)c(OC)c(OC)c3)n2)c1O
InChIInChI=1S/C21H21NO5/c1-24-17-10-5-7-14(20(17)23)16-9-6-8-15(22-16)13-11-18(25-2)21(27-4)19(12-13)26-3/h5-12,23H,1-4H3
InChIKeyKQBMYUNYMDGESD-UHFFFAOYSA-N
XLogP4.16
TPSA70.04 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.40
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

[6-(3-Hydroxy-4-methylphenyl)pyridin-2-yl](3,4,5-trimethoxyphenyl)methanone
CID 138857390
2-Fluoranyl-3-[6-(4-fluoranyl-3-oxidanyl-phenoxy)pyridin-2-yl]phenol
CID 134158356
4-(3-Methoxy-5-methylphenoxy)-2-(4-methoxyphenyl)-6-methylpyridine
CID 71460891
3-[(2-Methyl-6-Phenylpyridin-4-Yl)oxy]phenol
CID 71462587
Antitumor agent-164
CID 156583242
2-Methoxy-5-[1-(2-methylquinolin-4-yl)ethenyl]phenol
CID 137660123
2-[(E)-2-(3,4,5-trimethoxyphenyl)ethenyl]quinolin-8-ol
CID 6091989
3-(3,4-Dimethoxyphenyl)-1-ethyl-6,7-dimethoxyisoquinoline
CID 1119276
4,4'-(2,3-Quinoxalinediyl)bis(2-methoxyphenol)
CID 1361650
2-[(E)-2-(3,4,5-trimethoxyphenyl)ethenyl]quinoline
CID 5739621
2-methoxy-5-[6-methoxy-3-(3,4,5-trimethoxyphenyl)-1H-indol-2-yl]phenol
CID 10181414
[2-(hydroxymethyl)-1-(3,4,5-trimethoxyphenyl)-4H-pyrrolo[1,2-a]indol-3-yl]methanol
CID 42599623

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-6-[6-(3,4,5-trimethoxyphenyl)-2-pyridinyl]phenol?
The IUPAC name of 2-methoxy-6-[6-(3,4,5-trimethoxyphenyl)-2-pyridinyl]phenol (CID 136502284) is 2-methoxy-6-[6-(3,4,5-trimethoxyphenyl)-2-pyridinyl]phenol.
What is the SMILES notation for 2-methoxy-6-[6-(3,4,5-trimethoxyphenyl)-2-pyridinyl]phenol?
The canonical SMILES for 2-methoxy-6-[6-(3,4,5-trimethoxyphenyl)-2-pyridinyl]phenol is COc1cccc(-c2cccc(-c3cc(OC)c(OC)c(OC)c3)n2)c1O.
What is the InChIKey of 2-methoxy-6-[6-(3,4,5-trimethoxyphenyl)-2-pyridinyl]phenol?
The InChIKey is KQBMYUNYMDGESD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21NO5/c1-24-17-10-5-7-14(20(17)23)16-9-6-8-15(22-16)13-11-18(25-2)21(27-4)19(12-13)26-3/h5-12,23H,1-4H3.
What are the key properties of 2-methoxy-6-[6-(3,4,5-trimethoxyphenyl)-2-pyridinyl]phenol?
2-methoxy-6-[6-(3,4,5-trimethoxyphenyl)-2-pyridinyl]phenol has a molecular weight of 367.40 g/mol, XLogP of 4.16, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-6-[6-(3,4,5-trimethoxyphenyl)-2-pyridinyl]phenol is sourced from PubChem (CID 136502284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).