2-(methoxymethyl)-7-methyl-1,2,3,4-tetrahydroquinoline

C12H17NO — CID 83877848

IUPAC2-(methoxymethyl)-7-methyl-1,2,3,4-tetrahydroquinoline
SMILESCOCC1CCc2ccc(C)cc2N1
InChIInChI=1S/C12H17NO/c1-9-3-4-10-5-6-11(8-14-2)13-12(10)7-9/h3-4,7,11,13H,5-6,8H2,1-2H3
InChIKeyCFHZPXCOKGQTIR-UHFFFAOYSA-N
MW191.27 g/mol
LogP2.37
Rot. Bonds2

About 2-(methoxymethyl)-7-methyl-1,2,3,4-tetrahydroquinoline

2-(methoxymethyl)-7-methyl-1,2,3,4-tetrahydroquinoline (PubChem CID 83877848) has the molecular formula C12H17NO and a molecular weight of 191.27 g/mol. Its IUPAC name is 2-(methoxymethyl)-7-methyl-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name2-(methoxymethyl)-7-methyl-1,2,3,4-tetrahydroquinoline
PubChem CID83877848
Molecular FormulaC12H17NO
Molecular Weight191.27 g/mol
Exact Mass191.13
IUPAC Name2-(methoxymethyl)-7-methyl-1,2,3,4-tetrahydroquinoline
SMILESCOCC1CCc2ccc(C)cc2N1
InChIInChI=1S/C12H17NO/c1-9-3-4-10-5-6-11(8-14-2)13-12(10)7-9/h3-4,7,11,13H,5-6,8H2,1-2H3
InChIKeyCFHZPXCOKGQTIR-UHFFFAOYSA-N
XLogP2.37
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(7-methyl-1,2,3,4-tetrahydroquinolin-2-yl)methyl]guanidine;hydrochloride
CID 52995010
[(2R)-7-methoxy-1,2,3,4-tetrahydroquinolin-2-yl]methanol
CID 130625960
8-methoxy-2-(methoxymethyl)-1,2,3,4-tetrahydroquinoline
CID 83883204
ethyl 2-(6-methyl-1,2,3,4-tetrahydroquinolin-2-yl)acetate
CID 123645338
ethyl 8-methyl-2-oxo-1,3,4,5-tetrahydro-1-benzazepine-3-carboxylate
CID 142193926
(2S)-2,6-dimethyl-2,3-dihydro-1H-indole
CID 130731712
(1S)-N-(2-methoxyethyl)-6-methyl-2,3-dihydro-1H-inden-1-amine
CID 97357930
(2S)-2-ethyl-7-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline
CID 67764160
(2S)-2-ethyl-6-methoxy-1,2,3,4-tetrahydroquinoline
CID 131025344
(5-methyl-2,3-dihydro-1H-indol-2-yl)methanamine
CID 83860472
ethane;7-methyl-1,2,3,4-tetrahydroquinoline
CID 142224426
2,6-dimethyl-1,2,3,4-tetrahydroquinoline
CID 13094330

Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)-7-methyl-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 2-(methoxymethyl)-7-methyl-1,2,3,4-tetrahydroquinoline (CID 83877848) is 2-(methoxymethyl)-7-methyl-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 2-(methoxymethyl)-7-methyl-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 2-(methoxymethyl)-7-methyl-1,2,3,4-tetrahydroquinoline is COCC1CCc2ccc(C)cc2N1.
What is the InChIKey of 2-(methoxymethyl)-7-methyl-1,2,3,4-tetrahydroquinoline?
The InChIKey is CFHZPXCOKGQTIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO/c1-9-3-4-10-5-6-11(8-14-2)13-12(10)7-9/h3-4,7,11,13H,5-6,8H2,1-2H3.
What are the key properties of 2-(methoxymethyl)-7-methyl-1,2,3,4-tetrahydroquinoline?
2-(methoxymethyl)-7-methyl-1,2,3,4-tetrahydroquinoline has a molecular weight of 191.27 g/mol, XLogP of 2.37, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-7-methyl-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 83877848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).