2-(2-methoxyethoxy)-1-quinolin-7-ylethanone

C14H15NO3 — CID 114032528

IUPAC2-(2-methoxyethoxy)-1-quinolin-7-ylethanone
SMILESCOCCOCC(=O)c1ccc2cccnc2c1
InChIInChI=1S/C14H15NO3/c1-17-7-8-18-10-14(16)12-5-4-11-3-2-6-15-13(11)9-12/h2-6,9H,7-8,10H2,1H3
InChIKeyWQUDGXXKWDAYKB-UHFFFAOYSA-N
MW245.28 g/mol
LogP2.08
Rot. Bonds6

About 2-(2-methoxyethoxy)-1-quinolin-7-ylethanone

2-(2-methoxyethoxy)-1-quinolin-7-ylethanone (PubChem CID 114032528) has the molecular formula C14H15NO3 and a molecular weight of 245.28 g/mol. Its IUPAC name is 2-(2-methoxyethoxy)-1-quinolin-7-ylethanone.

Molecular Properties

Compound Name2-(2-methoxyethoxy)-1-quinolin-7-ylethanone
PubChem CID114032528
Molecular FormulaC14H15NO3
Molecular Weight245.28 g/mol
Exact Mass245.11
IUPAC Name2-(2-methoxyethoxy)-1-quinolin-7-ylethanone
SMILESCOCCOCC(=O)c1ccc2cccnc2c1
InChIInChI=1S/C14H15NO3/c1-17-7-8-18-10-14(16)12-5-4-11-3-2-6-15-13(11)9-12/h2-6,9H,7-8,10H2,1H3
InChIKeyWQUDGXXKWDAYKB-UHFFFAOYSA-N
XLogP2.08
TPSA48.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 52.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-amino-4-methoxy-1-quinolin-7-ylbutan-1-one
CID 116567245
2-(2-methoxyethoxy)-1-quinolin-5-ylethanone
CID 114032521
2-piperidin-4-yloxy-1-quinolin-7-ylethanone
CID 116571031
2-(prop-2-ynylamino)-1-quinolin-7-ylethanone
CID 116589414
1-(methylamino)ethyl quinoline-7-carboxylate
CID 141347103
(4-fluoro-3-methoxyphenyl)-quinolin-7-ylmethanone
CID 115790996
quinolin-7-yl quinoline-7-carboxylate
CID 142797869
2-amino-2-methyl-1-quinolin-7-ylpropan-1-one
CID 116560118
N-(2-aminoethyl)quinoline-7-carboxamide
CID 142187430
1-quinolin-7-ylprop-2-en-1-one
CID 103453564
1-(3-bromo-4-methoxyphenyl)-2-(2-methoxyethoxy)ethanone
CID 43799010
(6-methoxypyrimidin-4-yl)-quinolin-7-ylmethanone
CID 102950015

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethoxy)-1-quinolin-7-ylethanone?
The IUPAC name of 2-(2-methoxyethoxy)-1-quinolin-7-ylethanone (CID 114032528) is 2-(2-methoxyethoxy)-1-quinolin-7-ylethanone.
What is the SMILES notation for 2-(2-methoxyethoxy)-1-quinolin-7-ylethanone?
The canonical SMILES for 2-(2-methoxyethoxy)-1-quinolin-7-ylethanone is COCCOCC(=O)c1ccc2cccnc2c1.
What is the InChIKey of 2-(2-methoxyethoxy)-1-quinolin-7-ylethanone?
The InChIKey is WQUDGXXKWDAYKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO3/c1-17-7-8-18-10-14(16)12-5-4-11-3-2-6-15-13(11)9-12/h2-6,9H,7-8,10H2,1H3.
What are the key properties of 2-(2-methoxyethoxy)-1-quinolin-7-ylethanone?
2-(2-methoxyethoxy)-1-quinolin-7-ylethanone has a molecular weight of 245.28 g/mol, XLogP of 2.08, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethoxy)-1-quinolin-7-ylethanone is sourced from PubChem (CID 114032528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).