1-(5-fluoro-3-pyridinyl)-2-quinolin-4-ylethanone

C16H11FN2O — CID 105109077

IUPAC1-(5-fluoro-3-pyridinyl)-2-quinolin-4-ylethanone
SMILESO=C(Cc1ccnc2ccccc12)c1cncc(F)c1
InChIInChI=1S/C16H11FN2O/c17-13-7-12(9-18-10-13)16(20)8-11-5-6-19-15-4-2-1-3-14(11)15/h1-7,9-10H,8H2
InChIKeyYRBZMEUFBXVDTF-UHFFFAOYSA-N
MW266.28 g/mol
LogP3.19
Rot. Bonds3

About 1-(5-fluoro-3-pyridinyl)-2-quinolin-4-ylethanone

1-(5-fluoro-3-pyridinyl)-2-quinolin-4-ylethanone (PubChem CID 105109077) has the molecular formula C16H11FN2O and a molecular weight of 266.28 g/mol. Its IUPAC name is 1-(5-fluoro-3-pyridinyl)-2-quinolin-4-ylethanone.

Molecular Properties

Compound Name1-(5-fluoro-3-pyridinyl)-2-quinolin-4-ylethanone
PubChem CID105109077
Molecular FormulaC16H11FN2O
Molecular Weight266.28 g/mol
Exact Mass266.09
IUPAC Name1-(5-fluoro-3-pyridinyl)-2-quinolin-4-ylethanone
SMILESO=C(Cc1ccnc2ccccc12)c1cncc(F)c1
InChIInChI=1S/C16H11FN2O/c17-13-7-12(9-18-10-13)16(20)8-11-5-6-19-15-4-2-1-3-14(11)15/h1-7,9-10H,8H2
InChIKeyYRBZMEUFBXVDTF-UHFFFAOYSA-N
XLogP3.19
TPSA42.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.28
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(5-fluoro-3-pyridinyl)-2-quinolin-2-ylethanone
CID 105108919
1-(4-iodophenyl)-2-quinolin-4-ylethanone
CID 114979738
1-[2-(aminomethyl)-4-pyridinyl]-2-quinolin-4-ylethanone
CID 116601824
1-(5-fluoro-3-pyridinyl)-2-quinolin-4-ylethanol
CID 105107049
1-(5-fluoro-3-pyridinyl)-3-phenylpropane-1,3-dione
CID 114080622
(5-fluoro-3-pyridinyl)-isoquinolin-1-ylmethanone
CID 63948426
2-(2-bromo-5-fluorophenyl)-1-(5-fluoro-3-pyridinyl)ethanone
CID 105090104
1-(2-iodophenyl)-2-quinolin-4-ylethanone
CID 114979720
1-(5-methylpyrazin-2-yl)-2-quinolin-4-ylethanone
CID 105109033
1-(5-chloro-2-pyridinyl)-2-quinolin-4-ylethanone
CID 11140584
1-(2-methylsulfanylphenyl)-2-quinolin-4-ylethanone
CID 114979659
[1-(5-fluoro-3-pyridinyl)-2-quinolin-4-ylethyl]hydrazine
CID 105316387

Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoro-3-pyridinyl)-2-quinolin-4-ylethanone?
The IUPAC name of 1-(5-fluoro-3-pyridinyl)-2-quinolin-4-ylethanone (CID 105109077) is 1-(5-fluoro-3-pyridinyl)-2-quinolin-4-ylethanone.
What is the SMILES notation for 1-(5-fluoro-3-pyridinyl)-2-quinolin-4-ylethanone?
The canonical SMILES for 1-(5-fluoro-3-pyridinyl)-2-quinolin-4-ylethanone is O=C(Cc1ccnc2ccccc12)c1cncc(F)c1.
What is the InChIKey of 1-(5-fluoro-3-pyridinyl)-2-quinolin-4-ylethanone?
The InChIKey is YRBZMEUFBXVDTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11FN2O/c17-13-7-12(9-18-10-13)16(20)8-11-5-6-19-15-4-2-1-3-14(11)15/h1-7,9-10H,8H2.
What are the key properties of 1-(5-fluoro-3-pyridinyl)-2-quinolin-4-ylethanone?
1-(5-fluoro-3-pyridinyl)-2-quinolin-4-ylethanone has a molecular weight of 266.28 g/mol, XLogP of 3.19, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-fluoro-3-pyridinyl)-2-quinolin-4-ylethanone is sourced from PubChem (CID 105109077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).