6-ethoxy-1,2,2,4-tetramethyl-3,4-dihydroquinoline

C15H23NO — CID 14387762

IUPAC6-ethoxy-1,2,2,4-tetramethyl-3,4-dihydroquinoline
SMILESCCOc1ccc2c(c1)C(C)CC(C)(C)N2C
InChIInChI=1S/C15H23NO/c1-6-17-12-7-8-14-13(9-12)11(2)10-15(3,4)16(14)5/h7-9,11H,6,10H2,1-5H3
InChIKeyGKHSTGRTIFEBQG-UHFFFAOYSA-N
MW233.35 g/mol
LogP3.81
Rot. Bonds2

About 6-ethoxy-1,2,2,4-tetramethyl-3,4-dihydroquinoline

6-ethoxy-1,2,2,4-tetramethyl-3,4-dihydroquinoline (PubChem CID 14387762) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is 6-ethoxy-1,2,2,4-tetramethyl-3,4-dihydroquinoline.

Molecular Properties

Compound Name6-ethoxy-1,2,2,4-tetramethyl-3,4-dihydroquinoline
PubChem CID14387762
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC Name6-ethoxy-1,2,2,4-tetramethyl-3,4-dihydroquinoline
SMILESCCOc1ccc2c(c1)C(C)CC(C)(C)N2C
InChIInChI=1S/C15H23NO/c1-6-17-12-7-8-14-13(9-12)11(2)10-15(3,4)16(14)5/h7-9,11H,6,10H2,1-5H3
InChIKeyGKHSTGRTIFEBQG-UHFFFAOYSA-N
XLogP3.81
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.35
LogP ≤ 53.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

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Related Compounds

1,2,2,4,6-pentamethyl-3,4-dihydroquinoline
CID 14387761
(5E)-1-(4-ethoxyphenyl)-5-[[(4R)-1,2,2,4-tetramethyl-3,4-dihydroquinolin-6-yl]methylidene]-1,3-diazinane-2,4,6-trione
CID 99885422
4-[(6-ethoxy-2,2,4-trimethyl-3,4-dihydroquinolin-1-yl)sulfonyl]-N,N,1-trimethylpyrrole-2-carboxamide
CID 75458373
1-[(4R)-6-ethoxy-2,2,4-trimethyl-3,4-dihydroquinolin-1-yl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone
CID 99732254
1,2,2,4-tetramethyl-3,4-dihydroquinoline-6-carboxylic acid
CID 66490899
(5Z)-1-(3-ethoxyphenyl)-5-[(7-methoxy-1,2,2,4-tetramethyl-3,4-dihydroquinolin-6-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
CID 50859978
(5Z)-1-(3-ethoxyphenyl)-5-[(7-fluoro-1,2,2,4-tetramethyl-3,4-dihydroquinolin-6-yl)methylidene]-1,3-diazinane-2,4,6-trione
CID 50859631
(5E)-5-[(7-chloro-1,2,2,4-tetramethyl-3,4-dihydroquinolin-6-yl)methylidene]-1-(3-ethoxyphenyl)-1,3-diazinane-2,4,6-trione
CID 132677358
(5E)-5-[[(4R)-7-chloro-1,2,2,4-tetramethyl-3,4-dihydroquinolin-6-yl]methylidene]-1-(3-ethoxyphenyl)-1,3-diazinane-2,4,6-trione
CID 125043832
6-ethoxy-3,3,4-trimethyl-1,2-dihydroquinoxaline
CID 176936552
(3R)-5-ethoxy-1,3-dimethyl-3H-indol-2-one
CID 86313571
1-(7-methoxy-1,2,2,4-tetramethyl-3,4-dihydroquinolin-6-yl)-N-methylmethanamine
CID 133203028

Frequently Asked Questions

What is the IUPAC name of 6-ethoxy-1,2,2,4-tetramethyl-3,4-dihydroquinoline?
The IUPAC name of 6-ethoxy-1,2,2,4-tetramethyl-3,4-dihydroquinoline (CID 14387762) is 6-ethoxy-1,2,2,4-tetramethyl-3,4-dihydroquinoline.
What is the SMILES notation for 6-ethoxy-1,2,2,4-tetramethyl-3,4-dihydroquinoline?
The canonical SMILES for 6-ethoxy-1,2,2,4-tetramethyl-3,4-dihydroquinoline is CCOc1ccc2c(c1)C(C)CC(C)(C)N2C.
What is the InChIKey of 6-ethoxy-1,2,2,4-tetramethyl-3,4-dihydroquinoline?
The InChIKey is GKHSTGRTIFEBQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-6-17-12-7-8-14-13(9-12)11(2)10-15(3,4)16(14)5/h7-9,11H,6,10H2,1-5H3.
What are the key properties of 6-ethoxy-1,2,2,4-tetramethyl-3,4-dihydroquinoline?
6-ethoxy-1,2,2,4-tetramethyl-3,4-dihydroquinoline has a molecular weight of 233.35 g/mol, XLogP of 3.81, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethoxy-1,2,2,4-tetramethyl-3,4-dihydroquinoline is sourced from PubChem (CID 14387762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).