6-fluoro-3-pyridin-3-yl-2,3-dihydrochromen-4-one

C14H10FNO2 — CID 73055881

IUPAC6-fluoro-3-pyridin-3-yl-2,3-dihydrochromen-4-one
SMILESO=C1c2cc(F)ccc2OCC1c1cccnc1
InChIInChI=1S/C14H10FNO2/c15-10-3-4-13-11(6-10)14(17)12(8-18-13)9-2-1-5-16-7-9/h1-7,12H,8H2
InChIKeyAWTGRDYTUFOKOH-UHFFFAOYSA-N
MW243.24 g/mol
LogP2.58
Rot. Bonds1

About 6-fluoro-3-pyridin-3-yl-2,3-dihydrochromen-4-one

6-fluoro-3-pyridin-3-yl-2,3-dihydrochromen-4-one (PubChem CID 73055881) has the molecular formula C14H10FNO2 and a molecular weight of 243.24 g/mol. Its IUPAC name is 6-fluoro-3-pyridin-3-yl-2,3-dihydrochromen-4-one.

Molecular Properties

Compound Name6-fluoro-3-pyridin-3-yl-2,3-dihydrochromen-4-one
PubChem CID73055881
Molecular FormulaC14H10FNO2
Molecular Weight243.24 g/mol
Exact Mass243.07
IUPAC Name6-fluoro-3-pyridin-3-yl-2,3-dihydrochromen-4-one
SMILESO=C1c2cc(F)ccc2OCC1c1cccnc1
InChIInChI=1S/C14H10FNO2/c15-10-3-4-13-11(6-10)14(17)12(8-18-13)9-2-1-5-16-7-9/h1-7,12H,8H2
InChIKeyAWTGRDYTUFOKOH-UHFFFAOYSA-N
XLogP2.58
TPSA39.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.24
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5H-chromeno(2,3-b)pyridin-5-one
CID 659312
Uccf-029
CID 3163532
N-[(E)-(4-oxochromen-3-yl)methylideneamino]pyridine-4-carboxamide
CID 6897208
6-Bromo-2-(pyridin-3-YL)chroman-4-one
CID 10780793
4-(2-Benzofuranyl)pyridine
CID 65590
Inicarone
CID 65811
2-Phenyl-3-pyridin-4-ylmethylene-chroman-4-one
CID 6116651
(3E)-2-phenyl-3-(pyridin-4-ylmethylidene)chromen-4-one
CID 44266353
2-Pyridin-3-ylchromen-4-one
CID 241786
5-Methoxy-2-(pyridin-3-ylmethoxy)benzaldehyde
CID 16228199
Cyclopropyl-[4-[3-(4-pyridin-4-ylpiperidin-1-yl)propoxy]phenyl]methanone
CID 162643335
(3E)-3-(pyridin-2-ylmethylidene)chromen-4-one
CID 1551716

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-3-pyridin-3-yl-2,3-dihydrochromen-4-one?
The IUPAC name of 6-fluoro-3-pyridin-3-yl-2,3-dihydrochromen-4-one (CID 73055881) is 6-fluoro-3-pyridin-3-yl-2,3-dihydrochromen-4-one.
What is the SMILES notation for 6-fluoro-3-pyridin-3-yl-2,3-dihydrochromen-4-one?
The canonical SMILES for 6-fluoro-3-pyridin-3-yl-2,3-dihydrochromen-4-one is O=C1c2cc(F)ccc2OCC1c1cccnc1.
What is the InChIKey of 6-fluoro-3-pyridin-3-yl-2,3-dihydrochromen-4-one?
The InChIKey is AWTGRDYTUFOKOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10FNO2/c15-10-3-4-13-11(6-10)14(17)12(8-18-13)9-2-1-5-16-7-9/h1-7,12H,8H2.
What are the key properties of 6-fluoro-3-pyridin-3-yl-2,3-dihydrochromen-4-one?
6-fluoro-3-pyridin-3-yl-2,3-dihydrochromen-4-one has a molecular weight of 243.24 g/mol, XLogP of 2.58, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-3-pyridin-3-yl-2,3-dihydrochromen-4-one is sourced from PubChem (CID 73055881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).