6-[2-(2-methoxyphenyl)ethyl]-2-methyl-1,2,3,4-tetrahydroquinoline

C19H23NO — CID 105379417

IUPAC6-[2-(2-methoxyphenyl)ethyl]-2-methyl-1,2,3,4-tetrahydroquinoline
SMILESCOc1ccccc1CCc1ccc2c(c1)CCC(C)N2
InChIInChI=1S/C19H23NO/c1-14-7-10-17-13-15(9-12-18(17)20-14)8-11-16-5-3-4-6-19(16)21-2/h3-6,9,12-14,20H,7-8,10-11H2,1-2H3
InChIKeyIPNNEMNDDZRHCE-UHFFFAOYSA-N
MW281.40 g/mol
LogP4.23
Rot. Bonds4

About 6-[2-(2-methoxyphenyl)ethyl]-2-methyl-1,2,3,4-tetrahydroquinoline

6-[2-(2-methoxyphenyl)ethyl]-2-methyl-1,2,3,4-tetrahydroquinoline (PubChem CID 105379417) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is 6-[2-(2-methoxyphenyl)ethyl]-2-methyl-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name6-[2-(2-methoxyphenyl)ethyl]-2-methyl-1,2,3,4-tetrahydroquinoline
PubChem CID105379417
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC Name6-[2-(2-methoxyphenyl)ethyl]-2-methyl-1,2,3,4-tetrahydroquinoline
SMILESCOc1ccccc1CCc1ccc2c(c1)CCC(C)N2
InChIInChI=1S/C19H23NO/c1-14-7-10-17-13-15(9-12-18(17)20-14)8-11-16-5-3-4-6-19(16)21-2/h3-6,9,12-14,20H,7-8,10-11H2,1-2H3
InChIKeyIPNNEMNDDZRHCE-UHFFFAOYSA-N
XLogP4.23
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-(2,3-dimethoxyphenyl)-2-methyl-1,2,3,4-tetrahydroquinoline
CID 82784751
6-[(1-ethyl-4-methoxypyrazol-5-yl)methyl]-2-methyl-1,2,3,4-tetrahydroquinoline
CID 105379441
6-[(3,5-dimethylcyclohexyl)methyl]-2-methyl-1,2,3,4-tetrahydroquinoline
CID 105379430
N-[2-(2-methoxyphenyl)ethyl]-2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)acetamide
CID 110768444
7-methoxy-2-methyl-2,3,4,5-tetrahydro-1H-1-benzazepine
CID 12827785
5-butyl-2-(2-methoxyphenyl)-2,3-dihydro-1H-indole
CID 3984067
2-methyl-1,2,3,4-tetrahydroquinoline;titanium
CID 158265975
2-methyl-6-[(1-methylpyrazol-3-yl)methyl]-1,2,3,4-tetrahydroquinoline
CID 103131685
6-[(2-fluoro-4,6-dimethylphenyl)methyl]-2-methyl-1,2,3,4-tetrahydroquinoline
CID 106882345
1,4-dimethoxy-2,5-bis(2-phenylethyl)benzene
CID 102449129
2-[2-(2-methoxyphenyl)ethyl]phenol
CID 10775715
N-(5,6-dimethoxy-2,3-dihydro-1H-inden-1-yl)-3-(2-methoxyphenyl)propanamide
CID 110399723

Frequently Asked Questions

What is the IUPAC name of 6-[2-(2-methoxyphenyl)ethyl]-2-methyl-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 6-[2-(2-methoxyphenyl)ethyl]-2-methyl-1,2,3,4-tetrahydroquinoline (CID 105379417) is 6-[2-(2-methoxyphenyl)ethyl]-2-methyl-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 6-[2-(2-methoxyphenyl)ethyl]-2-methyl-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 6-[2-(2-methoxyphenyl)ethyl]-2-methyl-1,2,3,4-tetrahydroquinoline is COc1ccccc1CCc1ccc2c(c1)CCC(C)N2.
What is the InChIKey of 6-[2-(2-methoxyphenyl)ethyl]-2-methyl-1,2,3,4-tetrahydroquinoline?
The InChIKey is IPNNEMNDDZRHCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO/c1-14-7-10-17-13-15(9-12-18(17)20-14)8-11-16-5-3-4-6-19(16)21-2/h3-6,9,12-14,20H,7-8,10-11H2,1-2H3.
What are the key properties of 6-[2-(2-methoxyphenyl)ethyl]-2-methyl-1,2,3,4-tetrahydroquinoline?
6-[2-(2-methoxyphenyl)ethyl]-2-methyl-1,2,3,4-tetrahydroquinoline has a molecular weight of 281.40 g/mol, XLogP of 4.23, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(2-methoxyphenyl)ethyl]-2-methyl-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 105379417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).