2-quinolin-8-yloxyacetate

C11H8NO3- — CID 6950984

IUPAC2-quinolin-8-yloxyacetate
SMILESO=C([O-])COc1cccc2cccnc12
InChIInChI=1S/C11H9NO3/c13-10(14)7-15-9-5-1-3-8-4-2-6-12-11(8)9/h1-6H,7H2,(H,13,14)/p-1
InChIKeyPNKYIZBUGAZUHQ-UHFFFAOYSA-M
MW202.19 g/mol
LogP0.36
Rot. Bonds3

About 2-quinolin-8-yloxyacetate

2-quinolin-8-yloxyacetate (PubChem CID 6950984) has the molecular formula C11H8NO3- and a molecular weight of 202.19 g/mol. Its IUPAC name is 2-quinolin-8-yloxyacetate.

Molecular Properties

Compound Name2-quinolin-8-yloxyacetate
PubChem CID6950984
Molecular FormulaC11H8NO3-
Molecular Weight202.19 g/mol
Exact Mass202.05
IUPAC Name2-quinolin-8-yloxyacetate
SMILESO=C([O-])COc1cccc2cccnc12
InChIInChI=1S/C11H9NO3/c13-10(14)7-15-9-5-1-3-8-4-2-6-12-11(8)9/h1-6H,7H2,(H,13,14)/p-1
InChIKeyPNKYIZBUGAZUHQ-UHFFFAOYSA-M
XLogP0.36
TPSA62.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.19
LogP ≤ 50.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-methoxyethyl 2-quinolin-8-yloxyacetate
CID 71408859
N-tert-butyl-2-quinolin-8-yloxyacetamide
CID 7893996
N',N'-dimethyl-2-quinolin-8-yloxyacetohydrazide
CID 116820845
2-chloroethyl 2-quinolin-8-yloxyacetate
CID 71408832
2-[2-[(Z)-(quinolin-8-ylhydrazinylidene)methyl]phenoxy]acetate
CID 7640513
2-[2-(2-quinolin-8-yloxyacetyl)hydrazinyl]acetic acid
CID 4029060
8-[2-(chloromethyl)prop-2-enoxy]quinoline
CID 103066009
methyl 2,2-dimethyl-3-quinolin-8-yloxypropanoate
CID 79622266
1-(3-fluorophenyl)-2-quinolin-8-yloxyethanone
CID 43226497
2-ethoxyethyl 2-quinolin-8-yloxyacetate
CID 71408852
N-(2,2-dimethylpropyl)-2-quinolin-8-yloxyacetamide
CID 99820790
N'-(2-quinolin-8-yloxyacetyl)benzohydrazide
CID 2981693

Frequently Asked Questions

What is the IUPAC name of 2-quinolin-8-yloxyacetate?
The IUPAC name of 2-quinolin-8-yloxyacetate (CID 6950984) is 2-quinolin-8-yloxyacetate.
What is the SMILES notation for 2-quinolin-8-yloxyacetate?
The canonical SMILES for 2-quinolin-8-yloxyacetate is O=C([O-])COc1cccc2cccnc12.
What is the InChIKey of 2-quinolin-8-yloxyacetate?
The InChIKey is PNKYIZBUGAZUHQ-UHFFFAOYSA-M. The full InChI is InChI=1S/C11H9NO3/c13-10(14)7-15-9-5-1-3-8-4-2-6-12-11(8)9/h1-6H,7H2,(H,13,14)/p-1.
What are the key properties of 2-quinolin-8-yloxyacetate?
2-quinolin-8-yloxyacetate has a molecular weight of 202.19 g/mol, XLogP of 0.36, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-quinolin-8-yloxyacetate is sourced from PubChem (CID 6950984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).