2-(7-chloro-8-ethoxy-4-methylquinolin-2-yl)-4-methoxyphenol

C19H18ClNO3 — CID 169419996

IUPAC2-(7-chloro-8-ethoxy-4-methylquinolin-2-yl)-4-methoxyphenol
SMILESCCOc1c(Cl)ccc2c(C)cc(-c3cc(OC)ccc3O)nc12
InChIInChI=1S/C19H18ClNO3/c1-4-24-19-15(20)7-6-13-11(2)9-16(21-18(13)19)14-10-12(23-3)5-8-17(14)22/h5-10,22H,4H2,1-3H3
InChIKeyCHOQVWFBQUVTKV-UHFFFAOYSA-N
MW343.81 g/mol
LogP4.98
Rot. Bonds4

About 2-(7-chloro-8-ethoxy-4-methylquinolin-2-yl)-4-methoxyphenol

2-(7-chloro-8-ethoxy-4-methylquinolin-2-yl)-4-methoxyphenol (PubChem CID 169419996) has the molecular formula C19H18ClNO3 and a molecular weight of 343.81 g/mol. Its IUPAC name is 2-(7-chloro-8-ethoxy-4-methylquinolin-2-yl)-4-methoxyphenol.

Molecular Properties

Compound Name2-(7-chloro-8-ethoxy-4-methylquinolin-2-yl)-4-methoxyphenol
PubChem CID169419996
Molecular FormulaC19H18ClNO3
Molecular Weight343.81 g/mol
Exact Mass343.10
IUPAC Name2-(7-chloro-8-ethoxy-4-methylquinolin-2-yl)-4-methoxyphenol
SMILESCCOc1c(Cl)ccc2c(C)cc(-c3cc(OC)ccc3O)nc12
InChIInChI=1S/C19H18ClNO3/c1-4-24-19-15(20)7-6-13-11(2)9-16(21-18(13)19)14-10-12(23-3)5-8-17(14)22/h5-10,22H,4H2,1-3H3
InChIKeyCHOQVWFBQUVTKV-UHFFFAOYSA-N
XLogP4.98
TPSA51.58 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.81
LogP ≤ 54.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-hydroxy-5-methoxyphenyl)-6-methoxy-4-methylquinolin-7-ol
CID 169413526
2-[9-(2-hydroxyphenyl)-4,7-dimethyl-1,10-phenanthrolin-2-yl]phenol;platinum
CID 135975765
N-[2-(2-hydroxy-5-methoxyphenyl)-7-methoxy-4-methylquinolin-6-yl]-2-methoxyacetamide
CID 169413461
[2-(2-chloro-4,5-dimethoxyphenyl)-4,8-dimethylquinolin-7-yl]methanol
CID 169410865
2-[6-[6-(2-hydroxy-5-methoxyphenyl)-2-pyridinyl]-2-pyridinyl]-6-methylphenol
CID 159753268
6-[6-(2-chloro-5-methoxyphenyl)-3-hydroxy-2-pyridinyl]-4-oxohexanoic acid
CID 175432112
2-ethoxy-5-methoxy-1,3-dimethylbenzene
CID 130882299
4-chloro-2-ethyl-6-(4-methoxy-2-methylphenyl)pyrimidine
CID 80936399
2-(4-chlorophenyl)-4-methoxyphenol
CID 57199343
2-[6-[6-(2-hydroxy-5-methoxyphenyl)-2-pyridinyl]-2-pyridinyl]-5-methylphenol;manganese(3+);trichloride
CID 159050723
4-methoxy-2-[5-(2-methylphenyl)-1H-pyrazol-3-yl]phenol
CID 1358031
8-chloro-4-(2-chloro-5-methoxyphenyl)-2-methylquinoline
CID 68877483

Frequently Asked Questions

What is the IUPAC name of 2-(7-chloro-8-ethoxy-4-methylquinolin-2-yl)-4-methoxyphenol?
The IUPAC name of 2-(7-chloro-8-ethoxy-4-methylquinolin-2-yl)-4-methoxyphenol (CID 169419996) is 2-(7-chloro-8-ethoxy-4-methylquinolin-2-yl)-4-methoxyphenol.
What is the SMILES notation for 2-(7-chloro-8-ethoxy-4-methylquinolin-2-yl)-4-methoxyphenol?
The canonical SMILES for 2-(7-chloro-8-ethoxy-4-methylquinolin-2-yl)-4-methoxyphenol is CCOc1c(Cl)ccc2c(C)cc(-c3cc(OC)ccc3O)nc12.
What is the InChIKey of 2-(7-chloro-8-ethoxy-4-methylquinolin-2-yl)-4-methoxyphenol?
The InChIKey is CHOQVWFBQUVTKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18ClNO3/c1-4-24-19-15(20)7-6-13-11(2)9-16(21-18(13)19)14-10-12(23-3)5-8-17(14)22/h5-10,22H,4H2,1-3H3.
What are the key properties of 2-(7-chloro-8-ethoxy-4-methylquinolin-2-yl)-4-methoxyphenol?
2-(7-chloro-8-ethoxy-4-methylquinolin-2-yl)-4-methoxyphenol has a molecular weight of 343.81 g/mol, XLogP of 4.98, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-chloro-8-ethoxy-4-methylquinolin-2-yl)-4-methoxyphenol is sourced from PubChem (CID 169419996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).