6-chloro-2,2,3,4-tetramethyl-3,4-dihydro-1H-quinoline

C13H18ClN — CID 117193853

IUPAC6-chloro-2,2,3,4-tetramethyl-3,4-dihydro-1H-quinoline
SMILESCC1c2cc(Cl)ccc2NC(C)(C)C1C
InChIInChI=1S/C13H18ClN/c1-8-9(2)13(3,4)15-12-6-5-10(14)7-11(8)12/h5-9,15H,1-4H3
InChIKeyMAUQLJWGCQSMBW-UHFFFAOYSA-N
MW223.75 g/mol
LogP4.28
Rot. Bonds

About 6-chloro-2,2,3,4-tetramethyl-3,4-dihydro-1H-quinoline

6-chloro-2,2,3,4-tetramethyl-3,4-dihydro-1H-quinoline (PubChem CID 117193853) has the molecular formula C13H18ClN and a molecular weight of 223.75 g/mol. Its IUPAC name is 6-chloro-2,2,3,4-tetramethyl-3,4-dihydro-1H-quinoline.

Molecular Properties

Compound Name6-chloro-2,2,3,4-tetramethyl-3,4-dihydro-1H-quinoline
PubChem CID117193853
Molecular FormulaC13H18ClN
Molecular Weight223.75 g/mol
Exact Mass223.11
IUPAC Name6-chloro-2,2,3,4-tetramethyl-3,4-dihydro-1H-quinoline
SMILESCC1c2cc(Cl)ccc2NC(C)(C)C1C
InChIInChI=1S/C13H18ClN/c1-8-9(2)13(3,4)15-12-6-5-10(14)7-11(8)12/h5-9,15H,1-4H3
InChIKeyMAUQLJWGCQSMBW-UHFFFAOYSA-N
XLogP4.28
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.75
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

6-bromo-2,2,3,4-tetramethyl-3,4-dihydro-1H-quinoline
CID 117193854
2,2,3,4-tetramethyl-3,4-dihydro-1H-quinoline
CID 59233372
(2R,3R)-5-chloro-2,3-dimethyl-2,3-dihydro-1H-indole
CID 95430074
1-[(3S,4R)-6-chloro-3-hydroxy-2,2-dimethyl-3,4-dihydro-1H-quinolin-4-yl]pyrrolidin-2-one
CID 67870255
2,2,3,5-tetramethyl-1,3-dihydroindole
CID 117193754
6-chloro-4-methyl-1,4-dihydro-3,1-benzoxazin-2-one
CID 166066797
6-chloro-2,4-dimethyl-1,2,3,4-tetrahydroquinoline
CID 105449607
5-chloro-3-(5-chloro-2-methylanilino)-1,3-dihydroindol-2-one
CID 43097456
6-chloro-2-methyl-2-(4-methylphenyl)-4-phenyl-3,4-dihydro-1H-quinazoline
CID 15566234
5-chloro-2-methylidene-3-propan-2-yl-1,3-dihydroindole
CID 163580754
(2R,4S)-6-chloro-N-(4-chlorophenyl)-2-methyl-1,2,3,4-tetrahydroquinolin-4-amine
CID 21093001
2-(5-chloro-2,3-dihydro-1H-indol-3-yl)propan-2-ol
CID 117202115

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2,2,3,4-tetramethyl-3,4-dihydro-1H-quinoline?
The IUPAC name of 6-chloro-2,2,3,4-tetramethyl-3,4-dihydro-1H-quinoline (CID 117193853) is 6-chloro-2,2,3,4-tetramethyl-3,4-dihydro-1H-quinoline.
What is the SMILES notation for 6-chloro-2,2,3,4-tetramethyl-3,4-dihydro-1H-quinoline?
The canonical SMILES for 6-chloro-2,2,3,4-tetramethyl-3,4-dihydro-1H-quinoline is CC1c2cc(Cl)ccc2NC(C)(C)C1C.
What is the InChIKey of 6-chloro-2,2,3,4-tetramethyl-3,4-dihydro-1H-quinoline?
The InChIKey is MAUQLJWGCQSMBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18ClN/c1-8-9(2)13(3,4)15-12-6-5-10(14)7-11(8)12/h5-9,15H,1-4H3.
What are the key properties of 6-chloro-2,2,3,4-tetramethyl-3,4-dihydro-1H-quinoline?
6-chloro-2,2,3,4-tetramethyl-3,4-dihydro-1H-quinoline has a molecular weight of 223.75 g/mol, XLogP of 4.28, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2,2,3,4-tetramethyl-3,4-dihydro-1H-quinoline is sourced from PubChem (CID 117193853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).