2-methyl-4-(2,4,6-trimethylphenyl)-1,2,3,4-tetrahydroquinoline

C19H23N — CID 115503382

IUPAC2-methyl-4-(2,4,6-trimethylphenyl)-1,2,3,4-tetrahydroquinoline
SMILESCc1cc(C)c(C2CC(C)Nc3ccccc32)c(C)c1
InChIInChI=1S/C19H23N/c1-12-9-13(2)19(14(3)10-12)17-11-15(4)20-18-8-6-5-7-16(17)18/h5-10,15,17,20H,11H2,1-4H3
InChIKeyNRVIWGLHOHWDJQ-UHFFFAOYSA-N
MW265.40 g/mol
LogP4.95
Rot. Bonds1

About 2-methyl-4-(2,4,6-trimethylphenyl)-1,2,3,4-tetrahydroquinoline

2-methyl-4-(2,4,6-trimethylphenyl)-1,2,3,4-tetrahydroquinoline (PubChem CID 115503382) has the molecular formula C19H23N and a molecular weight of 265.40 g/mol. Its IUPAC name is 2-methyl-4-(2,4,6-trimethylphenyl)-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name2-methyl-4-(2,4,6-trimethylphenyl)-1,2,3,4-tetrahydroquinoline
PubChem CID115503382
Molecular FormulaC19H23N
Molecular Weight265.40 g/mol
Exact Mass265.18
IUPAC Name2-methyl-4-(2,4,6-trimethylphenyl)-1,2,3,4-tetrahydroquinoline
SMILESCc1cc(C)c(C2CC(C)Nc3ccccc32)c(C)c1
InChIInChI=1S/C19H23N/c1-12-9-13(2)19(14(3)10-12)17-11-15(4)20-18-8-6-5-7-16(17)18/h5-10,15,17,20H,11H2,1-4H3
InChIKeyNRVIWGLHOHWDJQ-UHFFFAOYSA-N
XLogP4.95
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 54.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-(3-fluoro-2-methylphenyl)-2-methyl-1,2,3,4-tetrahydroquinoline
CID 115502890
4-[(2-fluoro-4,6-dimethylphenyl)methyl]-2-methyl-1,2,3,4-tetrahydroquinoline
CID 106882341
4-methoxy-2-methyl-1,2,3,4-tetrahydroquinoline
CID 82275853
2-methyl-4-[(4-methylphenyl)methyl]-1,2,3,4-tetrahydroquinoline
CID 79234860
4-butan-2-yl-2-methyl-1,2,3,4-tetrahydroquinoline
CID 106780808
(2R,4R)-2-methyl-1,2,3,4-tetrahydroquinoline-4-carboxylic acid
CID 95566944
2,5,7-trimethyl-4-pyrrolidin-1-yl-1,2,3,4-tetrahydroquinoline
CID 82275992
(2S,4R)-4-ethoxy-2-methyl-1,2,3,4-tetrahydroquinoline
CID 131014008
(2R,4S)-2-methyl-N-phenyl-1,2,3,4-tetrahydroquinolin-4-amine
CID 715781
4-benzyl-2-methyl-1,2,3,4-tetrahydroquinoline
CID 79234771
2-methyl-4-pyrrolidin-1-yl-1,2,3,4-tetrahydroquinoline
CID 3724874
2-methyl-4-(3-propyltriazol-4-yl)-1,2,3,4-tetrahydroquinoline
CID 106781173

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-(2,4,6-trimethylphenyl)-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 2-methyl-4-(2,4,6-trimethylphenyl)-1,2,3,4-tetrahydroquinoline (CID 115503382) is 2-methyl-4-(2,4,6-trimethylphenyl)-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 2-methyl-4-(2,4,6-trimethylphenyl)-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 2-methyl-4-(2,4,6-trimethylphenyl)-1,2,3,4-tetrahydroquinoline is Cc1cc(C)c(C2CC(C)Nc3ccccc32)c(C)c1.
What is the InChIKey of 2-methyl-4-(2,4,6-trimethylphenyl)-1,2,3,4-tetrahydroquinoline?
The InChIKey is NRVIWGLHOHWDJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N/c1-12-9-13(2)19(14(3)10-12)17-11-15(4)20-18-8-6-5-7-16(17)18/h5-10,15,17,20H,11H2,1-4H3.
What are the key properties of 2-methyl-4-(2,4,6-trimethylphenyl)-1,2,3,4-tetrahydroquinoline?
2-methyl-4-(2,4,6-trimethylphenyl)-1,2,3,4-tetrahydroquinoline has a molecular weight of 265.40 g/mol, XLogP of 4.95, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-(2,4,6-trimethylphenyl)-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 115503382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).