1-(4-quinolin-7-yloxyphenyl)ethanone

C17H13NO2 — CID 107313857

IUPAC1-(4-quinolin-7-yloxyphenyl)ethanone
SMILESCC(=O)c1ccc(Oc2ccc3cccnc3c2)cc1
InChIInChI=1S/C17H13NO2/c1-12(19)13-4-7-15(8-5-13)20-16-9-6-14-3-2-10-18-17(14)11-16/h2-11H,1H3
InChIKeyRMRALGOGBWFLNU-UHFFFAOYSA-N
MW263.30 g/mol
LogP4.23
Rot. Bonds3

About 1-(4-quinolin-7-yloxyphenyl)ethanone

1-(4-quinolin-7-yloxyphenyl)ethanone (PubChem CID 107313857) has the molecular formula C17H13NO2 and a molecular weight of 263.30 g/mol. Its IUPAC name is 1-(4-quinolin-7-yloxyphenyl)ethanone.

Molecular Properties

Compound Name1-(4-quinolin-7-yloxyphenyl)ethanone
PubChem CID107313857
Molecular FormulaC17H13NO2
Molecular Weight263.30 g/mol
Exact Mass263.09
IUPAC Name1-(4-quinolin-7-yloxyphenyl)ethanone
SMILESCC(=O)c1ccc(Oc2ccc3cccnc3c2)cc1
InChIInChI=1S/C17H13NO2/c1-12(19)13-4-7-15(8-5-13)20-16-9-6-14-3-2-10-18-17(14)11-16/h2-11H,1H3
InChIKeyRMRALGOGBWFLNU-UHFFFAOYSA-N
XLogP4.23
TPSA39.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.30
LogP ≤ 54.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

7-pyridin-4-yloxyquinoline
CID 141187990
quinolin-7-yl quinoline-7-carboxylate
CID 142797869
(2-methyl-4-quinolin-7-yloxyphenyl)methanol
CID 107314118
2-chloro-4-quinolin-7-yloxybenzoic acid
CID 107315358
3-chloro-4-quinolin-7-yloxybenzoic acid
CID 107314076
quinolin-7-yl N,N-dimethylcarbamate
CID 11218314
1-[4-[(3-nitro-2-pyridinyl)oxy]phenyl]ethanone
CID 40676941
1-(4-pyridin-3-yloxyphenyl)ethanone
CID 3016094
7-[(2-chloro-4-pyridinyl)oxy]quinoline
CID 107313588
3-methyl-2-quinolin-7-yloxybutanoic acid
CID 107313050
4-methyl-2-quinolin-7-yloxybenzoic acid
CID 107313379
quinolin-7-yl N,N-diethylcarbamate
CID 11334036

Frequently Asked Questions

What is the IUPAC name of 1-(4-quinolin-7-yloxyphenyl)ethanone?
The IUPAC name of 1-(4-quinolin-7-yloxyphenyl)ethanone (CID 107313857) is 1-(4-quinolin-7-yloxyphenyl)ethanone.
What is the SMILES notation for 1-(4-quinolin-7-yloxyphenyl)ethanone?
The canonical SMILES for 1-(4-quinolin-7-yloxyphenyl)ethanone is CC(=O)c1ccc(Oc2ccc3cccnc3c2)cc1.
What is the InChIKey of 1-(4-quinolin-7-yloxyphenyl)ethanone?
The InChIKey is RMRALGOGBWFLNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13NO2/c1-12(19)13-4-7-15(8-5-13)20-16-9-6-14-3-2-10-18-17(14)11-16/h2-11H,1H3.
What are the key properties of 1-(4-quinolin-7-yloxyphenyl)ethanone?
1-(4-quinolin-7-yloxyphenyl)ethanone has a molecular weight of 263.30 g/mol, XLogP of 4.23, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-quinolin-7-yloxyphenyl)ethanone is sourced from PubChem (CID 107313857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).