2-methoxy-6-(4-methyl-8-propan-2-yloxyquinolin-2-yl)phenol

C20H21NO3 — CID 169410777

IUPAC2-methoxy-6-(4-methyl-8-propan-2-yloxyquinolin-2-yl)phenol
SMILESCOc1cccc(-c2cc(C)c3cccc(OC(C)C)c3n2)c1O
InChIInChI=1S/C20H21NO3/c1-12(2)24-17-9-5-7-14-13(3)11-16(21-19(14)17)15-8-6-10-18(23-4)20(15)22/h5-12,22H,1-4H3
InChIKeyYEGSTJIWEBASPD-UHFFFAOYSA-N
MW323.39 g/mol
LogP4.71
Rot. Bonds4

About 2-methoxy-6-(4-methyl-8-propan-2-yloxyquinolin-2-yl)phenol

2-methoxy-6-(4-methyl-8-propan-2-yloxyquinolin-2-yl)phenol (PubChem CID 169410777) has the molecular formula C20H21NO3 and a molecular weight of 323.39 g/mol. Its IUPAC name is 2-methoxy-6-(4-methyl-8-propan-2-yloxyquinolin-2-yl)phenol.

Molecular Properties

Compound Name2-methoxy-6-(4-methyl-8-propan-2-yloxyquinolin-2-yl)phenol
PubChem CID169410777
Molecular FormulaC20H21NO3
Molecular Weight323.39 g/mol
Exact Mass323.15
IUPAC Name2-methoxy-6-(4-methyl-8-propan-2-yloxyquinolin-2-yl)phenol
SMILESCOc1cccc(-c2cc(C)c3cccc(OC(C)C)c3n2)c1O
InChIInChI=1S/C20H21NO3/c1-12(2)24-17-9-5-7-14-13(3)11-16(21-19(14)17)15-8-6-10-18(23-4)20(15)22/h5-12,22H,1-4H3
InChIKeyYEGSTJIWEBASPD-UHFFFAOYSA-N
XLogP4.71
TPSA51.58 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.39
LogP ≤ 54.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(6,7-dimethoxy-4-methylquinolin-2-yl)-6-methoxyphenol
CID 169417890
1-(4-methyl-8-propan-2-yloxyquinolin-2-yl)ethanol
CID 82575997
methyl 2-(4-methyl-8-propan-2-yloxyquinolin-2-yl)acetate
CID 82575130
[2-(4-fluoro-2-methoxyphenyl)-4-methylquinolin-8-yl]methanol
CID 170505269
2-[2-[2-(2-hydroxyethoxy)phenyl]-4-methylquinolin-8-yl]ethanol
CID 169412939
2,4-dichloro-8-propan-2-yloxyquinoline
CID 82581120
4-methoxy-7-methyl-6-propan-2-yloxyquinoline
CID 144937171
2-methyl-8-propan-2-yloxyquinoline-4-carbothioamide
CID 82574267
2-(6-bromo-4-methyl-1H-benzimidazol-2-yl)-6-methoxyphenol
CID 136727868
2-ethoxy-8-methoxy-4-methylquinoline
CID 70328444
[2-(2-ethoxyphenyl)-4,8-dimethylquinolin-7-yl]methanol
CID 169420711
2-(7-methoxy-1H-indol-3-yl)-4-methylquinoline
CID 118449001

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-6-(4-methyl-8-propan-2-yloxyquinolin-2-yl)phenol?
The IUPAC name of 2-methoxy-6-(4-methyl-8-propan-2-yloxyquinolin-2-yl)phenol (CID 169410777) is 2-methoxy-6-(4-methyl-8-propan-2-yloxyquinolin-2-yl)phenol.
What is the SMILES notation for 2-methoxy-6-(4-methyl-8-propan-2-yloxyquinolin-2-yl)phenol?
The canonical SMILES for 2-methoxy-6-(4-methyl-8-propan-2-yloxyquinolin-2-yl)phenol is COc1cccc(-c2cc(C)c3cccc(OC(C)C)c3n2)c1O.
What is the InChIKey of 2-methoxy-6-(4-methyl-8-propan-2-yloxyquinolin-2-yl)phenol?
The InChIKey is YEGSTJIWEBASPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21NO3/c1-12(2)24-17-9-5-7-14-13(3)11-16(21-19(14)17)15-8-6-10-18(23-4)20(15)22/h5-12,22H,1-4H3.
What are the key properties of 2-methoxy-6-(4-methyl-8-propan-2-yloxyquinolin-2-yl)phenol?
2-methoxy-6-(4-methyl-8-propan-2-yloxyquinolin-2-yl)phenol has a molecular weight of 323.39 g/mol, XLogP of 4.71, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-6-(4-methyl-8-propan-2-yloxyquinolin-2-yl)phenol is sourced from PubChem (CID 169410777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).