6-chloro-2,4-dimethyl-1,2,3,4-tetrahydroquinoline

C11H14ClN — CID 105449607

IUPAC6-chloro-2,4-dimethyl-1,2,3,4-tetrahydroquinoline
SMILESCC1CC(C)c2cc(Cl)ccc2N1
InChIInChI=1S/C11H14ClN/c1-7-5-8(2)13-11-4-3-9(12)6-10(7)11/h3-4,6-8,13H,5H2,1-2H3
InChIKeyXVTKEVWMEPEEAB-UHFFFAOYSA-N
MW195.69 g/mol
LogP3.65
Rot. Bonds

About 6-chloro-2,4-dimethyl-1,2,3,4-tetrahydroquinoline

6-chloro-2,4-dimethyl-1,2,3,4-tetrahydroquinoline (PubChem CID 105449607) has the molecular formula C11H14ClN and a molecular weight of 195.69 g/mol. Its IUPAC name is 6-chloro-2,4-dimethyl-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name6-chloro-2,4-dimethyl-1,2,3,4-tetrahydroquinoline
PubChem CID105449607
Molecular FormulaC11H14ClN
Molecular Weight195.69 g/mol
Exact Mass195.08
IUPAC Name6-chloro-2,4-dimethyl-1,2,3,4-tetrahydroquinoline
SMILESCC1CC(C)c2cc(Cl)ccc2N1
InChIInChI=1S/C11H14ClN/c1-7-5-8(2)13-11-4-3-9(12)6-10(7)11/h3-4,6-8,13H,5H2,1-2H3
InChIKeyXVTKEVWMEPEEAB-UHFFFAOYSA-N
XLogP3.65
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.69
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2R,4S)-6-chloro-N-(4-chlorophenyl)-2-methyl-1,2,3,4-tetrahydroquinolin-4-amine
CID 21093001
[(2S,4R)-6-chloro-2-methyl-1,2,3,4-tetrahydroquinolin-4-yl]carbamic acid
CID 68921650
4-(6-chloro-2-methyl-1,2,3,4-tetrahydroquinolin-4-yl)morpholine
CID 82275927
(2R,3R)-5-chloro-2,3-dimethyl-2,3-dihydro-1H-indole
CID 95430074
7-chloro-4-methoxy-2-methyl-1,2,3,4-tetrahydroquinoline
CID 82275034
7-chloro-4-methyl-1,2,3,4-tetrahydroquinoline
CID 16744775
(1R,9R,10S)-4-chloro-12-oxa-8-azatricyclo[7.3.1.02,7]trideca-2(7),3,5-trien-10-ol
CID 56654246
(5R)-7-chloro-5-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine;hydrate;hydrochloride
CID 11658859
(5R)-7-chloro-5-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine;7-chloro-5-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine;hydrate;dihydrochloride
CID 66613234
(1S)-7-chloro-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol
CID 115417859
6-chloro-4-propan-2-yl-1,2,3,4-tetrahydroquinoline
CID 105463734
2-(5-chloro-2-methoxyphenyl)-4-methylazetidine
CID 116821949

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2,4-dimethyl-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 6-chloro-2,4-dimethyl-1,2,3,4-tetrahydroquinoline (CID 105449607) is 6-chloro-2,4-dimethyl-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 6-chloro-2,4-dimethyl-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 6-chloro-2,4-dimethyl-1,2,3,4-tetrahydroquinoline is CC1CC(C)c2cc(Cl)ccc2N1.
What is the InChIKey of 6-chloro-2,4-dimethyl-1,2,3,4-tetrahydroquinoline?
The InChIKey is XVTKEVWMEPEEAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClN/c1-7-5-8(2)13-11-4-3-9(12)6-10(7)11/h3-4,6-8,13H,5H2,1-2H3.
What are the key properties of 6-chloro-2,4-dimethyl-1,2,3,4-tetrahydroquinoline?
6-chloro-2,4-dimethyl-1,2,3,4-tetrahydroquinoline has a molecular weight of 195.69 g/mol, XLogP of 3.65, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2,4-dimethyl-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 105449607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).