ethyl 2-(8-methoxy-2-methylquinolin-3-yl)acetate

C15H17NO3 — CID 171788302

IUPACethyl 2-(8-methoxy-2-methylquinolin-3-yl)acetate
SMILESCCOC(=O)Cc1cc2cccc(OC)c2nc1C
InChIInChI=1S/C15H17NO3/c1-4-19-14(17)9-12-8-11-6-5-7-13(18-3)15(11)16-10(12)2/h5-8H,4,9H2,1-3H3
InChIKeyDHNUODMGRJWWEP-UHFFFAOYSA-N
MW259.30 g/mol
LogP2.66
Rot. Bonds4

About ethyl 2-(8-methoxy-2-methylquinolin-3-yl)acetate

ethyl 2-(8-methoxy-2-methylquinolin-3-yl)acetate (PubChem CID 171788302) has the molecular formula C15H17NO3 and a molecular weight of 259.30 g/mol. Its IUPAC name is ethyl 2-(8-methoxy-2-methylquinolin-3-yl)acetate.

Molecular Properties

Compound Nameethyl 2-(8-methoxy-2-methylquinolin-3-yl)acetate
PubChem CID171788302
Molecular FormulaC15H17NO3
Molecular Weight259.30 g/mol
Exact Mass259.12
IUPAC Nameethyl 2-(8-methoxy-2-methylquinolin-3-yl)acetate
SMILESCCOC(=O)Cc1cc2cccc(OC)c2nc1C
InChIInChI=1S/C15H17NO3/c1-4-19-14(17)9-12-8-11-6-5-7-13(18-3)15(11)16-10(12)2/h5-8H,4,9H2,1-3H3
InChIKeyDHNUODMGRJWWEP-UHFFFAOYSA-N
XLogP2.66
TPSA48.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.30
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-methylpropyl 2-(8-chloro-2-methylquinolin-3-yl)acetate
CID 167151257
8-methoxy-3-propylquinolin-2-amine
CID 63232389
ethyl 2-quinolin-8-ylacetate
CID 52562898
ethyl 2-[3-(2-methoxyphenyl)imidazo[1,2-a]pyridin-2-yl]acetate
CID 156579945
ethyl 2-(4-hydroxy-2-methoxyphenyl)acetate
CID 105463832
ethyl 2-(5-carbamoyl-2,6-dimethyl-3-pyridinyl)acetate
CID 151319204
2-amino-8-methoxyquinoline-3-carboxylic acid
CID 84622747
ethyl 2-[2-(2-methoxyphenyl)-1,3-thiazol-4-yl]acetate
CID 15336769
ethyl 2-(7-methoxy-1-benzofuran-3-yl)acetate
CID 22734085
ethyl 2-(5-amino-7-methoxy-[1,2,4]triazolo[1,5-c]quinazolin-2-yl)acetate
CID 90257651
ethyl 2-(3-chloro-4-methoxy-2-methylphenyl)acetate
CID 171005875
ethyl 2-(5-methoxy-2-methyl-4-pyridinyl)acetate
CID 5314331

Frequently Asked Questions

What is the IUPAC name of ethyl 2-(8-methoxy-2-methylquinolin-3-yl)acetate?
The IUPAC name of ethyl 2-(8-methoxy-2-methylquinolin-3-yl)acetate (CID 171788302) is ethyl 2-(8-methoxy-2-methylquinolin-3-yl)acetate.
What is the SMILES notation for ethyl 2-(8-methoxy-2-methylquinolin-3-yl)acetate?
The canonical SMILES for ethyl 2-(8-methoxy-2-methylquinolin-3-yl)acetate is CCOC(=O)Cc1cc2cccc(OC)c2nc1C.
What is the InChIKey of ethyl 2-(8-methoxy-2-methylquinolin-3-yl)acetate?
The InChIKey is DHNUODMGRJWWEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO3/c1-4-19-14(17)9-12-8-11-6-5-7-13(18-3)15(11)16-10(12)2/h5-8H,4,9H2,1-3H3.
What are the key properties of ethyl 2-(8-methoxy-2-methylquinolin-3-yl)acetate?
ethyl 2-(8-methoxy-2-methylquinolin-3-yl)acetate has a molecular weight of 259.30 g/mol, XLogP of 2.66, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(8-methoxy-2-methylquinolin-3-yl)acetate is sourced from PubChem (CID 171788302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).