4-[1-(4-methoxyphenyl)ethyl]-2-methylquinoline

C19H19NO — CID 123434354

IUPAC4-[1-(4-methoxyphenyl)ethyl]-2-methylquinoline
SMILESCOc1ccc(C(C)c2cc(C)nc3ccccc23)cc1
InChIInChI=1S/C19H19NO/c1-13-12-18(17-6-4-5-7-19(17)20-13)14(2)15-8-10-16(21-3)11-9-15/h4-12,14H,1-3H3
InChIKeyUCCODUCSUOCKCZ-UHFFFAOYSA-N
MW277.37 g/mol
LogP4.70
Rot. Bonds3

About 4-[1-(4-methoxyphenyl)ethyl]-2-methylquinoline

4-[1-(4-methoxyphenyl)ethyl]-2-methylquinoline (PubChem CID 123434354) has the molecular formula C19H19NO and a molecular weight of 277.37 g/mol. Its IUPAC name is 4-[1-(4-methoxyphenyl)ethyl]-2-methylquinoline.

Molecular Properties

Compound Name4-[1-(4-methoxyphenyl)ethyl]-2-methylquinoline
PubChem CID123434354
Molecular FormulaC19H19NO
Molecular Weight277.37 g/mol
Exact Mass277.15
IUPAC Name4-[1-(4-methoxyphenyl)ethyl]-2-methylquinoline
SMILESCOc1ccc(C(C)c2cc(C)nc3ccccc23)cc1
InChIInChI=1S/C19H19NO/c1-13-12-18(17-6-4-5-7-19(17)20-13)14(2)15-8-10-16(21-3)11-9-15/h4-12,14H,1-3H3
InChIKeyUCCODUCSUOCKCZ-UHFFFAOYSA-N
XLogP4.70
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 54.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(4-chlorophenyl)-(2-methylquinolin-4-yl)methanol
CID 79234879
N-methyl-3-(2-methylquinolin-4-yl)butan-2-amine
CID 63199652
2-(4-methylphenyl)-2-(2-methylquinolin-4-yl)acetonitrile
CID 18802151
(4-methoxyphenyl)-(4-methylquinolin-2-yl)methanol
CID 114754870
1-(4-chlorophenyl)-N-methyl-1-(2-methylquinolin-4-yl)methanamine
CID 105076264
(2-chloroquinazolin-4-yl)-(4-methoxyphenyl)methanamine;hydrochloride
CID 87276665
(4-methoxyphenyl)-quinolin-4-ylmethanol
CID 63893984
(4-methoxyphenyl)methyl-(2-methylquinolin-4-yl)diazene
CID 91898142
(4-fluoro-3-methylphenyl)-(2-methylquinolin-4-yl)methanol
CID 79233806
6-methoxy-2-methyl-4-phenylquinoline
CID 12787220
(3-ethylphenyl)-(2-methylquinolin-4-yl)methanamine
CID 105171179
1-(4-methoxyphenyl)-N-methyl-1-quinolin-4-ylmethanamine
CID 105095031

Frequently Asked Questions

What is the IUPAC name of 4-[1-(4-methoxyphenyl)ethyl]-2-methylquinoline?
The IUPAC name of 4-[1-(4-methoxyphenyl)ethyl]-2-methylquinoline (CID 123434354) is 4-[1-(4-methoxyphenyl)ethyl]-2-methylquinoline.
What is the SMILES notation for 4-[1-(4-methoxyphenyl)ethyl]-2-methylquinoline?
The canonical SMILES for 4-[1-(4-methoxyphenyl)ethyl]-2-methylquinoline is COc1ccc(C(C)c2cc(C)nc3ccccc23)cc1.
What is the InChIKey of 4-[1-(4-methoxyphenyl)ethyl]-2-methylquinoline?
The InChIKey is UCCODUCSUOCKCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19NO/c1-13-12-18(17-6-4-5-7-19(17)20-13)14(2)15-8-10-16(21-3)11-9-15/h4-12,14H,1-3H3.
What are the key properties of 4-[1-(4-methoxyphenyl)ethyl]-2-methylquinoline?
4-[1-(4-methoxyphenyl)ethyl]-2-methylquinoline has a molecular weight of 277.37 g/mol, XLogP of 4.70, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(4-methoxyphenyl)ethyl]-2-methylquinoline is sourced from PubChem (CID 123434354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).