6-(2-methoxyphenyl)-2,2,4-trimethyl-1H-quinoline

C19H21NO — CID 22566515

IUPAC6-(2-methoxyphenyl)-2,2,4-trimethyl-1H-quinoline
SMILESCOc1ccccc1-c1ccc2c(c1)C(C)=CC(C)(C)N2
InChIInChI=1S/C19H21NO/c1-13-12-19(2,3)20-17-10-9-14(11-16(13)17)15-7-5-6-8-18(15)21-4/h5-12,20H,1-4H3
InChIKeyQRLZVPMAUWNKEO-UHFFFAOYSA-N
MW279.38 g/mol
LogP4.97
Rot. Bonds2

About 6-(2-methoxyphenyl)-2,2,4-trimethyl-1H-quinoline

6-(2-methoxyphenyl)-2,2,4-trimethyl-1H-quinoline (PubChem CID 22566515) has the molecular formula C19H21NO and a molecular weight of 279.38 g/mol. Its IUPAC name is 6-(2-methoxyphenyl)-2,2,4-trimethyl-1H-quinoline.

Molecular Properties

Compound Name6-(2-methoxyphenyl)-2,2,4-trimethyl-1H-quinoline
PubChem CID22566515
Molecular FormulaC19H21NO
Molecular Weight279.38 g/mol
Exact Mass279.16
IUPAC Name6-(2-methoxyphenyl)-2,2,4-trimethyl-1H-quinoline
SMILESCOc1ccccc1-c1ccc2c(c1)C(C)=CC(C)(C)N2
InChIInChI=1S/C19H21NO/c1-13-12-19(2,3)20-17-10-9-14(11-16(13)17)15-7-5-6-8-18(15)21-4/h5-12,20H,1-4H3
InChIKeyQRLZVPMAUWNKEO-UHFFFAOYSA-N
XLogP4.97
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 54.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Ethoxyquin
CID 3293
(5Z)-2,2,4-trimethyl-5-[(2-methylphenyl)methylidene]-1H-chromeno[3,4-f]quinoline
CID 9951771
4-(4-methoxyphenyl)-1H-quinolin-2-one
CID 672272
10-methoxy-5-(2-propenyl)-2,5-dihydro-2,2,4-trimethyl-1H-(1)benzopyrano(3,4-f)quinoline
CID 9906282
4-Allylsulfanylmethyl-6-(2-methoxyphenyl)-2,2-dimethyl-1,2-dihydroquinoline
CID 9950357
Thioacetic acid S-[6-(2-methoxyphenyl)-2,2-dimethyl-1,2-dihydroquinolin-4-ylmethyl] ester
CID 9998207
6-(2-methoxyphenyl)-2,2-dimethyl-4-{1-[(2E)-pent-2-en-1-yloxy]ethyl}-1,2-dihydroquinoline
CID 9999671
6-(2-Methoxyphenyl)-2,2-dimethyl-4-phenethylsulfanylmethyl-1,2-dihydroquinoline
CID 10001914
6-(2-Methoxyphenyl)-2,2-dimethyl-4-[1-(prop-2-en-1-yloxy)propyl]-1,2-dihydroquinoline
CID 10021634
6-(2-Methoxyphenyl)-2,2-dimethyl-4-[2-methyl-1-(prop-2-en-1-yloxy)propyl]-1,2-dihydroquinoline
CID 10068183
4-[1-(2-Cyclohexylethoxy)ethyl]-6-(2-methoxyphenyl)-2,2-dimethyl-1,2-dihydroquinoline
CID 10070722
6-(2-Methoxyphenyl)-2,2-dimethyl-4-[3-phenyl-1-(prop-2-en-1-yloxy)propyl]-1,2-dihydroquinoline
CID 10071910

Frequently Asked Questions

What is the IUPAC name of 6-(2-methoxyphenyl)-2,2,4-trimethyl-1H-quinoline?
The IUPAC name of 6-(2-methoxyphenyl)-2,2,4-trimethyl-1H-quinoline (CID 22566515) is 6-(2-methoxyphenyl)-2,2,4-trimethyl-1H-quinoline.
What is the SMILES notation for 6-(2-methoxyphenyl)-2,2,4-trimethyl-1H-quinoline?
The canonical SMILES for 6-(2-methoxyphenyl)-2,2,4-trimethyl-1H-quinoline is COc1ccccc1-c1ccc2c(c1)C(C)=CC(C)(C)N2.
What is the InChIKey of 6-(2-methoxyphenyl)-2,2,4-trimethyl-1H-quinoline?
The InChIKey is QRLZVPMAUWNKEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO/c1-13-12-19(2,3)20-17-10-9-14(11-16(13)17)15-7-5-6-8-18(15)21-4/h5-12,20H,1-4H3.
What are the key properties of 6-(2-methoxyphenyl)-2,2,4-trimethyl-1H-quinoline?
6-(2-methoxyphenyl)-2,2,4-trimethyl-1H-quinoline has a molecular weight of 279.38 g/mol, XLogP of 4.97, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methoxyphenyl)-2,2,4-trimethyl-1H-quinoline is sourced from PubChem (CID 22566515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).