2-methoxyethyl 2-quinolin-8-yloxyacetate

C14H15NO4 — CID 71408859

IUPAC2-methoxyethyl 2-quinolin-8-yloxyacetate
SMILESCOCCOC(=O)COc1cccc2cccnc12
InChIInChI=1S/C14H15NO4/c1-17-8-9-18-13(16)10-19-12-6-2-4-11-5-3-7-15-14(11)12/h2-7H,8-10H2,1H3
InChIKeyIJDIBVCUWZNGIW-UHFFFAOYSA-N
MW261.28 g/mol
LogP1.80
Rot. Bonds6

About 2-methoxyethyl 2-quinolin-8-yloxyacetate

2-methoxyethyl 2-quinolin-8-yloxyacetate (PubChem CID 71408859) has the molecular formula C14H15NO4 and a molecular weight of 261.28 g/mol. Its IUPAC name is 2-methoxyethyl 2-quinolin-8-yloxyacetate.

Molecular Properties

Compound Name2-methoxyethyl 2-quinolin-8-yloxyacetate
PubChem CID71408859
Molecular FormulaC14H15NO4
Molecular Weight261.28 g/mol
Exact Mass261.10
IUPAC Name2-methoxyethyl 2-quinolin-8-yloxyacetate
SMILESCOCCOC(=O)COc1cccc2cccnc12
InChIInChI=1S/C14H15NO4/c1-17-8-9-18-13(16)10-19-12-6-2-4-11-5-3-7-15-14(11)12/h2-7H,8-10H2,1H3
InChIKeyIJDIBVCUWZNGIW-UHFFFAOYSA-N
XLogP1.80
TPSA57.65 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.28
LogP ≤ 51.80
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-ethoxyethyl 2-quinolin-8-yloxyacetate
CID 71408852
2-chloroethyl 2-quinolin-8-yloxyacetate
CID 71408832
[(1-amino-2-quinolin-8-yloxyethylidene)amino] 2-methoxyacetate
CID 71320086
2-quinolin-8-yloxyacetate
CID 6950984
(2-oxo-2-thiophen-2-ylethyl) 2-quinolin-8-yloxyacetate
CID 2395878
methyl 2,2-dimethyl-3-quinolin-8-yloxypropanoate
CID 79622266
N-(2,2-dimethylpropyl)-2-quinolin-8-yloxyacetamide
CID 99820790
N-tert-butyl-2-quinolin-8-yloxyacetamide
CID 7893996
N',N'-dimethyl-2-quinolin-8-yloxyacetohydrazide
CID 116820845
N-(3-ethoxypropyl)-2-quinolin-8-yloxyacetamide
CID 71408811
N-(1-aminopropan-2-yl)-2-quinolin-8-yloxyacetamide
CID 110834168
2-quinolin-8-yloxyethanamine
CID 17174906

Frequently Asked Questions

What is the IUPAC name of 2-methoxyethyl 2-quinolin-8-yloxyacetate?
The IUPAC name of 2-methoxyethyl 2-quinolin-8-yloxyacetate (CID 71408859) is 2-methoxyethyl 2-quinolin-8-yloxyacetate.
What is the SMILES notation for 2-methoxyethyl 2-quinolin-8-yloxyacetate?
The canonical SMILES for 2-methoxyethyl 2-quinolin-8-yloxyacetate is COCCOC(=O)COc1cccc2cccnc12.
What is the InChIKey of 2-methoxyethyl 2-quinolin-8-yloxyacetate?
The InChIKey is IJDIBVCUWZNGIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO4/c1-17-8-9-18-13(16)10-19-12-6-2-4-11-5-3-7-15-14(11)12/h2-7H,8-10H2,1H3.
What are the key properties of 2-methoxyethyl 2-quinolin-8-yloxyacetate?
2-methoxyethyl 2-quinolin-8-yloxyacetate has a molecular weight of 261.28 g/mol, XLogP of 1.80, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxyethyl 2-quinolin-8-yloxyacetate is sourced from PubChem (CID 71408859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).