4-methoxy-2-methyl-1,2,3,4-tetrahydroquinoline

C11H15NO — CID 82275853

IUPAC4-methoxy-2-methyl-1,2,3,4-tetrahydroquinoline
SMILESCOC1CC(C)Nc2ccccc21
InChIInChI=1S/C11H15NO/c1-8-7-11(13-2)9-5-3-4-6-10(9)12-8/h3-6,8,11-12H,7H2,1-2H3
InChIKeyCCXAHMULNABIRB-UHFFFAOYSA-N
MW177.25 g/mol
LogP2.58
Rot. Bonds1

About 4-methoxy-2-methyl-1,2,3,4-tetrahydroquinoline

4-methoxy-2-methyl-1,2,3,4-tetrahydroquinoline (PubChem CID 82275853) has the molecular formula C11H15NO and a molecular weight of 177.25 g/mol. Its IUPAC name is 4-methoxy-2-methyl-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name4-methoxy-2-methyl-1,2,3,4-tetrahydroquinoline
PubChem CID82275853
Molecular FormulaC11H15NO
Molecular Weight177.25 g/mol
Exact Mass177.12
IUPAC Name4-methoxy-2-methyl-1,2,3,4-tetrahydroquinoline
SMILESCOC1CC(C)Nc2ccccc21
InChIInChI=1S/C11H15NO/c1-8-7-11(13-2)9-5-3-4-6-10(9)12-8/h3-6,8,11-12H,7H2,1-2H3
InChIKeyCCXAHMULNABIRB-UHFFFAOYSA-N
XLogP2.58
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S,4R)-4-ethoxy-2-methyl-1,2,3,4-tetrahydroquinoline
CID 131014008
7-chloro-4-methoxy-2-methyl-1,2,3,4-tetrahydroquinoline
CID 82275034
(2R,4S)-4-butoxy-2-methyl-1,2,3,4-tetrahydroquinoline
CID 25242139
(2R,4R)-2-(4-fluorophenyl)-4-methoxy-1,2,3,4-tetrahydroquinoline
CID 124562870
4-methoxy-1,2,3,4-tetrahydroquinoline
CID 82275496
(2R,4R)-2-methyl-1,2,3,4-tetrahydroquinoline-4-carboxylic acid
CID 95566944
(2R,4S)-2-methyl-N-phenyl-1,2,3,4-tetrahydroquinolin-4-amine
CID 715781
2-methyl-4-pyrrolidin-1-yl-1,2,3,4-tetrahydroquinoline
CID 3724874
4-benzyl-2-methyl-1,2,3,4-tetrahydroquinoline
CID 79234771
4-butan-2-yl-2-methyl-1,2,3,4-tetrahydroquinoline
CID 106780808
2-methyl-4-piperidin-1-yl-1,2,3,4-tetrahydroquinoline
CID 82275850
2-methyl-4-pentyl-1,2,3,4-tetrahydroquinoline
CID 106778499

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-methyl-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 4-methoxy-2-methyl-1,2,3,4-tetrahydroquinoline (CID 82275853) is 4-methoxy-2-methyl-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 4-methoxy-2-methyl-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 4-methoxy-2-methyl-1,2,3,4-tetrahydroquinoline is COC1CC(C)Nc2ccccc21.
What is the InChIKey of 4-methoxy-2-methyl-1,2,3,4-tetrahydroquinoline?
The InChIKey is CCXAHMULNABIRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO/c1-8-7-11(13-2)9-5-3-4-6-10(9)12-8/h3-6,8,11-12H,7H2,1-2H3.
What are the key properties of 4-methoxy-2-methyl-1,2,3,4-tetrahydroquinoline?
4-methoxy-2-methyl-1,2,3,4-tetrahydroquinoline has a molecular weight of 177.25 g/mol, XLogP of 2.58, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-methyl-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 82275853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).