4-ethyl-2,2,6-trimethyl-1H-quinoline

C14H19N — CID 54180937

IUPAC4-ethyl-2,2,6-trimethyl-1H-quinoline
SMILESCCC1=CC(C)(C)Nc2ccc(C)cc21
InChIInChI=1S/C14H19N/c1-5-11-9-14(3,4)15-13-7-6-10(2)8-12(11)13/h6-9,15H,5H2,1-4H3
InChIKeyPBSVILSALXTKBN-UHFFFAOYSA-N
MW201.31 g/mol
LogP3.99
Rot. Bonds1

About 4-ethyl-2,2,6-trimethyl-1H-quinoline

4-ethyl-2,2,6-trimethyl-1H-quinoline (PubChem CID 54180937) has the molecular formula C14H19N and a molecular weight of 201.31 g/mol. Its IUPAC name is 4-ethyl-2,2,6-trimethyl-1H-quinoline.

Molecular Properties

Compound Name4-ethyl-2,2,6-trimethyl-1H-quinoline
PubChem CID54180937
Molecular FormulaC14H19N
Molecular Weight201.31 g/mol
Exact Mass201.15
IUPAC Name4-ethyl-2,2,6-trimethyl-1H-quinoline
SMILESCCC1=CC(C)(C)Nc2ccc(C)cc21
InChIInChI=1S/C14H19N/c1-5-11-9-14(3,4)15-13-7-6-10(2)8-12(11)13/h6-9,15H,5H2,1-4H3
InChIKeyPBSVILSALXTKBN-UHFFFAOYSA-N
XLogP3.99
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,4-diethyl-2,6-dimethyl-1H-quinoline
CID 4528207
4-chloro-2,2,6-trimethyl-1H-quinoline
CID 119090674
2,4-diethyl-2-methyl-6-propan-2-yl-1H-quinoline
CID 101173813
2,2,4-trimethyl-6-(3-methylphenyl)-1H-quinoline
CID 23433463
2,2,4-trimethyl-N-(4-methylphenyl)-1H-quinolin-6-amine
CID 154263778
5-(chloromethyl)-6-(2-methoxy-5-methylphenyl)-2,2,4-trimethyl-1H-quinoline
CID 58026827
2,2,4-trimethyl-6-pentyl-1H-quinoline
CID 66970055
6-ethoxy-2,2,4-trimethyl-1H-quinoline;oxoiron
CID 67924358
1,2-diethyl-4-methylbenzene;methane
CID 174446118
4-(bromomethyl)-2,2-dimethyl-1,6-dihydroquinolin-6-ide;yttrium(3+)
CID 54704183
4-(bromomethyl)-2,2-dimethyl-1,6-dihydroquinolin-6-ide;yttrium
CID 59985843
6-(4-fluorophenyl)-2,2,4-trimethyl-1H-quinoline
CID 23433471

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2,2,6-trimethyl-1H-quinoline?
The IUPAC name of 4-ethyl-2,2,6-trimethyl-1H-quinoline (CID 54180937) is 4-ethyl-2,2,6-trimethyl-1H-quinoline.
What is the SMILES notation for 4-ethyl-2,2,6-trimethyl-1H-quinoline?
The canonical SMILES for 4-ethyl-2,2,6-trimethyl-1H-quinoline is CCC1=CC(C)(C)Nc2ccc(C)cc21.
What is the InChIKey of 4-ethyl-2,2,6-trimethyl-1H-quinoline?
The InChIKey is PBSVILSALXTKBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N/c1-5-11-9-14(3,4)15-13-7-6-10(2)8-12(11)13/h6-9,15H,5H2,1-4H3.
What are the key properties of 4-ethyl-2,2,6-trimethyl-1H-quinoline?
4-ethyl-2,2,6-trimethyl-1H-quinoline has a molecular weight of 201.31 g/mol, XLogP of 3.99, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2,2,6-trimethyl-1H-quinoline is sourced from PubChem (CID 54180937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).