6-(2-ethoxyethoxy)-2-(2-methoxy-4-pyridinyl)-4-methylquinoline

C20H22N2O3 — CID 169414076

IUPAC6-(2-ethoxyethoxy)-2-(2-methoxy-4-pyridinyl)-4-methylquinoline
SMILESCCOCCOc1ccc2nc(-c3ccnc(OC)c3)cc(C)c2c1
InChIInChI=1S/C20H22N2O3/c1-4-24-9-10-25-16-5-6-18-17(13-16)14(2)11-19(22-18)15-7-8-21-20(12-15)23-3/h5-8,11-13H,4,9-10H2,1-3H3
InChIKeyTYFIRZYOKIKAKI-UHFFFAOYSA-N
MW338.41 g/mol
LogP4.03
Rot. Bonds7

About 6-(2-ethoxyethoxy)-2-(2-methoxy-4-pyridinyl)-4-methylquinoline

6-(2-ethoxyethoxy)-2-(2-methoxy-4-pyridinyl)-4-methylquinoline (PubChem CID 169414076) has the molecular formula C20H22N2O3 and a molecular weight of 338.41 g/mol. Its IUPAC name is 6-(2-ethoxyethoxy)-2-(2-methoxy-4-pyridinyl)-4-methylquinoline.

Molecular Properties

Compound Name6-(2-ethoxyethoxy)-2-(2-methoxy-4-pyridinyl)-4-methylquinoline
PubChem CID169414076
Molecular FormulaC20H22N2O3
Molecular Weight338.41 g/mol
Exact Mass338.16
IUPAC Name6-(2-ethoxyethoxy)-2-(2-methoxy-4-pyridinyl)-4-methylquinoline
SMILESCCOCCOc1ccc2nc(-c3ccnc(OC)c3)cc(C)c2c1
InChIInChI=1S/C20H22N2O3/c1-4-24-9-10-25-16-5-6-18-17(13-16)14(2)11-19(22-18)15-7-8-21-20(12-15)23-3/h5-8,11-13H,4,9-10H2,1-3H3
InChIKeyTYFIRZYOKIKAKI-UHFFFAOYSA-N
XLogP4.03
TPSA53.47 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 54.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[4-(4-butoxyphenyl)-3-fluorophenyl]-6-fluoro-4-methylquinoline
CID 170148996
6-(2,6-dichlorophenoxy)-2-(2-fluoro-4-pyridinyl)-4-methylquinoline
CID 175921287
dichloroplatinum;4-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]-2-[4-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]-2-pyridinyl]pyridine;1-[2-(2-ethoxyethoxy)ethoxy]propane
CID 157395071
4-(2-ethoxyethoxy)-N-(4-methoxyphenyl)-2-methyl-N-phenylaniline
CID 18996715
6-ethoxy-2-(4-ethoxyphenyl)quinoline-4-carboxylic acid
CID 3511446
1-bromo-4-(2-ethoxyethoxy)-2-methylbenzene
CID 83134041
ethyl 2-(2-methoxy-4-pyridinyl)-4-methylimidazo[1,5-a]pyrimidine-8-carboxylate
CID 131988114
2-(3-chloro-4-methoxyphenyl)-6-ethoxyquinoline-4-carboxylic acid
CID 3925337
(6-ethoxy-4-methylquinolin-2-yl)hydrazine
CID 82017717
6-ethoxy-4-methylquinoline-2-carboxylic acid
CID 82574771
4-methoxy-2-(2-methoxy-4-pyridinyl)benzaldehyde
CID 172649224
6-(4-ethoxyphenyl)-8-methyl-[1,3]dioxolo[4,5-g]quinoline;hydrochloride
CID 42997566

Frequently Asked Questions

What is the IUPAC name of 6-(2-ethoxyethoxy)-2-(2-methoxy-4-pyridinyl)-4-methylquinoline?
The IUPAC name of 6-(2-ethoxyethoxy)-2-(2-methoxy-4-pyridinyl)-4-methylquinoline (CID 169414076) is 6-(2-ethoxyethoxy)-2-(2-methoxy-4-pyridinyl)-4-methylquinoline.
What is the SMILES notation for 6-(2-ethoxyethoxy)-2-(2-methoxy-4-pyridinyl)-4-methylquinoline?
The canonical SMILES for 6-(2-ethoxyethoxy)-2-(2-methoxy-4-pyridinyl)-4-methylquinoline is CCOCCOc1ccc2nc(-c3ccnc(OC)c3)cc(C)c2c1.
What is the InChIKey of 6-(2-ethoxyethoxy)-2-(2-methoxy-4-pyridinyl)-4-methylquinoline?
The InChIKey is TYFIRZYOKIKAKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O3/c1-4-24-9-10-25-16-5-6-18-17(13-16)14(2)11-19(22-18)15-7-8-21-20(12-15)23-3/h5-8,11-13H,4,9-10H2,1-3H3.
What are the key properties of 6-(2-ethoxyethoxy)-2-(2-methoxy-4-pyridinyl)-4-methylquinoline?
6-(2-ethoxyethoxy)-2-(2-methoxy-4-pyridinyl)-4-methylquinoline has a molecular weight of 338.41 g/mol, XLogP of 4.03, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-ethoxyethoxy)-2-(2-methoxy-4-pyridinyl)-4-methylquinoline is sourced from PubChem (CID 169414076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).