7-(2-methoxy-4,6-dimethylphenyl)-1,2,3,4-tetrahydroquinoline

C18H21NO — CID 106781897

IUPAC7-(2-methoxy-4,6-dimethylphenyl)-1,2,3,4-tetrahydroquinoline
SMILESCOc1cc(C)cc(C)c1-c1ccc2c(c1)NCCC2
InChIInChI=1S/C18H21NO/c1-12-9-13(2)18(17(10-12)20-3)15-7-6-14-5-4-8-19-16(14)11-15/h6-7,9-11,19H,4-5,8H2,1-3H3
InChIKeyIDFWNJFVJJWYRV-UHFFFAOYSA-N
MW267.37 g/mol
LogP4.34
Rot. Bonds2

About 7-(2-methoxy-4,6-dimethylphenyl)-1,2,3,4-tetrahydroquinoline

7-(2-methoxy-4,6-dimethylphenyl)-1,2,3,4-tetrahydroquinoline (PubChem CID 106781897) has the molecular formula C18H21NO and a molecular weight of 267.37 g/mol. Its IUPAC name is 7-(2-methoxy-4,6-dimethylphenyl)-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name7-(2-methoxy-4,6-dimethylphenyl)-1,2,3,4-tetrahydroquinoline
PubChem CID106781897
Molecular FormulaC18H21NO
Molecular Weight267.37 g/mol
Exact Mass267.16
IUPAC Name7-(2-methoxy-4,6-dimethylphenyl)-1,2,3,4-tetrahydroquinoline
SMILESCOc1cc(C)cc(C)c1-c1ccc2c(c1)NCCC2
InChIInChI=1S/C18H21NO/c1-12-9-13(2)18(17(10-12)20-3)15-7-6-14-5-4-8-19-16(14)11-15/h6-7,9-11,19H,4-5,8H2,1-3H3
InChIKeyIDFWNJFVJJWYRV-UHFFFAOYSA-N
XLogP4.34
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

7-(3,4-dimethoxyphenyl)-1,2,3,4-tetrahydroquinoline
CID 81224481
6-(2,4,6-trimethoxyphenyl)-2,3-dihydro-1H-indole
CID 116698533
7-(2,4-dimethoxyphenyl)-1,2,3,4-tetrahydroquinoline
CID 81224636
7-(5-fluoro-2-methoxyphenyl)-1,2,3,4-tetrahydroquinoline
CID 81224324
6-methoxy-7-methyl-1,2,3,4-tetrahydroquinoline
CID 84656157
6-(4-methoxy-3-methylphenyl)-1,2,3,4-tetrahydroquinoline
CID 62500963
ethane;7-methyl-1,2,3,4-tetrahydroquinoline
CID 142224426
4-(2-methoxy-4,6-dimethylphenyl)phenol
CID 106681641
7-naphthalen-2-yl-1,2,3,4-tetrahydroquinoline
CID 81230530
6-methoxy-7-phenyl-1,2,3,4-tetrahydroquinoline
CID 23078397
6-(2,3,4,5,6-pentamethylphenyl)-1,2,3,4-tetrahydroquinoline
CID 63424137
6-(2,3-dimethoxyphenyl)-2,3-dihydro-1H-indole
CID 116698516

Frequently Asked Questions

What is the IUPAC name of 7-(2-methoxy-4,6-dimethylphenyl)-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 7-(2-methoxy-4,6-dimethylphenyl)-1,2,3,4-tetrahydroquinoline (CID 106781897) is 7-(2-methoxy-4,6-dimethylphenyl)-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 7-(2-methoxy-4,6-dimethylphenyl)-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 7-(2-methoxy-4,6-dimethylphenyl)-1,2,3,4-tetrahydroquinoline is COc1cc(C)cc(C)c1-c1ccc2c(c1)NCCC2.
What is the InChIKey of 7-(2-methoxy-4,6-dimethylphenyl)-1,2,3,4-tetrahydroquinoline?
The InChIKey is IDFWNJFVJJWYRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO/c1-12-9-13(2)18(17(10-12)20-3)15-7-6-14-5-4-8-19-16(14)11-15/h6-7,9-11,19H,4-5,8H2,1-3H3.
What are the key properties of 7-(2-methoxy-4,6-dimethylphenyl)-1,2,3,4-tetrahydroquinoline?
7-(2-methoxy-4,6-dimethylphenyl)-1,2,3,4-tetrahydroquinoline has a molecular weight of 267.37 g/mol, XLogP of 4.34, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2-methoxy-4,6-dimethylphenyl)-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 106781897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).