2-(2-methoxy-3,4-dimethylphenyl)-3-methyl-1,2,3,4-tetrahydroquinoline

C19H23NO — CID 106781932

IUPAC2-(2-methoxy-3,4-dimethylphenyl)-3-methyl-1,2,3,4-tetrahydroquinoline
SMILESCOc1c(C2Nc3ccccc3CC2C)ccc(C)c1C
InChIInChI=1S/C19H23NO/c1-12-9-10-16(19(21-4)14(12)3)18-13(2)11-15-7-5-6-8-17(15)20-18/h5-10,13,18,20H,11H2,1-4H3
InChIKeyCHHVPDTUCHEEGT-UHFFFAOYSA-N
MW281.40 g/mol
LogP4.66
Rot. Bonds2

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

2-(2-methoxy-3,4-dimethylphenyl)-3-methyl-1,2,3,4-tetrahydroquinoline (PubChem CID 106781932) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is 2-(2-methoxy-3,4-dimethylphenyl)-3-methyl-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name2-(2-methoxy-3,4-dimethylphenyl)-3-methyl-1,2,3,4-tetrahydroquinoline
PubChem CID106781932
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC Name2-(2-methoxy-3,4-dimethylphenyl)-3-methyl-1,2,3,4-tetrahydroquinoline
SMILESCOc1c(C2Nc3ccccc3CC2C)ccc(C)c1C
InChIInChI=1S/C19H23NO/c1-12-9-10-16(19(21-4)14(12)3)18-13(2)11-15-7-5-6-8-17(15)20-18/h5-10,13,18,20H,11H2,1-4H3
InChIKeyCHHVPDTUCHEEGT-UHFFFAOYSA-N
XLogP4.66
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-methoxy-3,4-dimethylphenyl)-3-methylpiperidine
CID 106781936
2-(2,3-difluorophenyl)-3-methyl-1,2,3,4-tetrahydroquinoline
CID 115502761
3-methyl-2-(2,4,5-trifluorophenyl)-1,2,3,4-tetrahydroquinoline
CID 115503214
(2S,3S)-2,3-dimethyl-1,2,3,4-tetrahydroquinoline
CID 102507922
(2R,3S)-2-cyclopropyl-3-methyl-1,2,3,4-tetrahydroquinoline
CID 139325811
(2R,3R)-2-ethyl-3-methyl-1,2,3,4-tetrahydroquinoline
CID 15312191
2,3-dihydro-1H-inden-2-yl-(2-methoxy-3,4-dimethylphenyl)methanamine
CID 103433624
(2R)-2-methyl-2,3-dihydro-1H-indole;hydrochloride
CID 155819591
(2R,3R)-2-(fluoromethyl)-3-methyl-1,2,3,4-tetrahydroquinoline
CID 139326096
3-(3-methoxy-2,4-dimethylphenyl)pyrrolidine
CID 117293921
2-(2,3-dihydro-1H-indol-2-yl)propan-2-ol
CID 14668660
2-cycloheptyl-3-methyl-1,2,3,4-tetrahydroquinoline
CID 106781039

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxy-3,4-dimethylphenyl)-3-methyl-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 2-(2-methoxy-3,4-dimethylphenyl)-3-methyl-1,2,3,4-tetrahydroquinoline (CID 106781932) is 2-(2-methoxy-3,4-dimethylphenyl)-3-methyl-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 2-(2-methoxy-3,4-dimethylphenyl)-3-methyl-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 2-(2-methoxy-3,4-dimethylphenyl)-3-methyl-1,2,3,4-tetrahydroquinoline is COc1c(C2Nc3ccccc3CC2C)ccc(C)c1C.
What is the InChIKey of 2-(2-methoxy-3,4-dimethylphenyl)-3-methyl-1,2,3,4-tetrahydroquinoline?
The InChIKey is CHHVPDTUCHEEGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO/c1-12-9-10-16(19(21-4)14(12)3)18-13(2)11-15-7-5-6-8-17(15)20-18/h5-10,13,18,20H,11H2,1-4H3.
What are the key properties of 2-(2-methoxy-3,4-dimethylphenyl)-3-methyl-1,2,3,4-tetrahydroquinoline?
2-(2-methoxy-3,4-dimethylphenyl)-3-methyl-1,2,3,4-tetrahydroquinoline has a molecular weight of 281.40 g/mol, XLogP of 4.66, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxy-3,4-dimethylphenyl)-3-methyl-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 106781932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).