6-ethyl-3-phenyl-5,6,7,8-tetrahydroquinoline

C17H19N — CID 82116961

IUPAC6-ethyl-3-phenyl-5,6,7,8-tetrahydroquinoline
SMILESCCC1CCc2ncc(-c3ccccc3)cc2C1
InChIInChI=1S/C17H19N/c1-2-13-8-9-17-15(10-13)11-16(12-18-17)14-6-4-3-5-7-14/h3-7,11-13H,2,8-10H2,1H3
InChIKeyXGLSSPZURSODJM-UHFFFAOYSA-N
MW237.35 g/mol
LogP4.26
Rot. Bonds2

About 6-ethyl-3-phenyl-5,6,7,8-tetrahydroquinoline

6-ethyl-3-phenyl-5,6,7,8-tetrahydroquinoline (PubChem CID 82116961) has the molecular formula C17H19N and a molecular weight of 237.35 g/mol. Its IUPAC name is 6-ethyl-3-phenyl-5,6,7,8-tetrahydroquinoline.

Molecular Properties

Compound Name6-ethyl-3-phenyl-5,6,7,8-tetrahydroquinoline
PubChem CID82116961
Molecular FormulaC17H19N
Molecular Weight237.35 g/mol
Exact Mass237.15
IUPAC Name6-ethyl-3-phenyl-5,6,7,8-tetrahydroquinoline
SMILESCCC1CCc2ncc(-c3ccccc3)cc2C1
InChIInChI=1S/C17H19N/c1-2-13-8-9-17-15(10-13)11-16(12-18-17)14-6-4-3-5-7-14/h3-7,11-13H,2,8-10H2,1H3
InChIKeyXGLSSPZURSODJM-UHFFFAOYSA-N
XLogP4.26
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 54.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Triprolidine
CID 5282443
(+-)-Dimethindene
CID 21855
Quinoline
CID 7047
Pheniramine
CID 4761
6-Methylquinoline
CID 7059
Azatadine
CID 19861
Triprolidine Hydrochloride Anhydrous
CID 5702129
4-Methylquinoline
CID 10285
Benzo(F)Quinoline
CID 6796
2-(3-Phenylpropyl)Pyridine
CID 459494
8-Methylquinoline
CID 11910
3-Phenylpyridine
CID 13886

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-3-phenyl-5,6,7,8-tetrahydroquinoline?
The IUPAC name of 6-ethyl-3-phenyl-5,6,7,8-tetrahydroquinoline (CID 82116961) is 6-ethyl-3-phenyl-5,6,7,8-tetrahydroquinoline.
What is the SMILES notation for 6-ethyl-3-phenyl-5,6,7,8-tetrahydroquinoline?
The canonical SMILES for 6-ethyl-3-phenyl-5,6,7,8-tetrahydroquinoline is CCC1CCc2ncc(-c3ccccc3)cc2C1.
What is the InChIKey of 6-ethyl-3-phenyl-5,6,7,8-tetrahydroquinoline?
The InChIKey is XGLSSPZURSODJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N/c1-2-13-8-9-17-15(10-13)11-16(12-18-17)14-6-4-3-5-7-14/h3-7,11-13H,2,8-10H2,1H3.
What are the key properties of 6-ethyl-3-phenyl-5,6,7,8-tetrahydroquinoline?
6-ethyl-3-phenyl-5,6,7,8-tetrahydroquinoline has a molecular weight of 237.35 g/mol, XLogP of 4.26, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-3-phenyl-5,6,7,8-tetrahydroquinoline is sourced from PubChem (CID 82116961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).