2-[[2-(3-fluorophenyl)-3,4-dihydro-2H-chromen-6-yl]oxy]pyridine

C20H16FNO2 — CID 142675808

IUPAC2-[[2-(3-fluorophenyl)-3,4-dihydro-2H-chromen-6-yl]oxy]pyridine
SMILESFc1cccc(C2CCc3cc(Oc4ccccn4)ccc3O2)c1
InChIInChI=1S/C20H16FNO2/c21-16-5-3-4-14(12-16)18-9-7-15-13-17(8-10-19(15)24-18)23-20-6-1-2-11-22-20/h1-6,8,10-13,18H,7,9H2
InChIKeyDHMRVQCJLWFBAW-UHFFFAOYSA-N
MW321.35 g/mol
LogP5.08
Rot. Bonds3

About 2-[[2-(3-fluorophenyl)-3,4-dihydro-2H-chromen-6-yl]oxy]pyridine

2-[[2-(3-fluorophenyl)-3,4-dihydro-2H-chromen-6-yl]oxy]pyridine (PubChem CID 142675808) has the molecular formula C20H16FNO2 and a molecular weight of 321.35 g/mol. Its IUPAC name is 2-[[2-(3-fluorophenyl)-3,4-dihydro-2H-chromen-6-yl]oxy]pyridine.

Molecular Properties

Compound Name2-[[2-(3-fluorophenyl)-3,4-dihydro-2H-chromen-6-yl]oxy]pyridine
PubChem CID142675808
Molecular FormulaC20H16FNO2
Molecular Weight321.35 g/mol
Exact Mass321.12
IUPAC Name2-[[2-(3-fluorophenyl)-3,4-dihydro-2H-chromen-6-yl]oxy]pyridine
SMILESFc1cccc(C2CCc3cc(Oc4ccccn4)ccc3O2)c1
InChIInChI=1S/C20H16FNO2/c21-16-5-3-4-14(12-16)18-9-7-15-13-17(8-10-19(15)24-18)23-20-6-1-2-11-22-20/h1-6,8,10-13,18H,7,9H2
InChIKeyDHMRVQCJLWFBAW-UHFFFAOYSA-N
XLogP5.08
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500321.35
LogP ≤ 55.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-dimethyl-6-[(2-phenyl-3,4-dihydro-2H-chromen-6-yl)oxy]pyridin-3-amine
CID 69017074
6-[(2-phenyl-3,4-dihydro-2H-chromen-6-yl)oxy]pyridine-3-carboxylic acid
CID 159522239
2-[[(2S)-2-phenyl-3,4-dihydro-2H-chromen-6-yl]oxy]-1,3-thiazole
CID 71293645
5-chloro-2-[[2-(2-fluorophenyl)-3,4-dihydro-2H-chromen-6-yl]oxy]pyridine
CID 69017550
2-(3-pyridin-2-yloxyphenyl)-2,3-dihydrochromen-4-one
CID 142675803
3-nitro-2-[[(2S)-2-phenyl-3,4-dihydro-2H-chromen-6-yl]oxy]pyridine
CID 91345018
6-hydroxy-2-(3-pyridin-2-yloxyphenyl)-2,3-dihydrochromen-4-one
CID 69016686
2-methyl-1-[6-[(2-phenyl-3,4-dihydro-2H-chromen-6-yl)oxy]-3-pyridinyl]guanidine
CID 69015492
6-[[2-[3-[(5-nitro-2-pyridinyl)oxy]phenyl]-3,4-dihydro-2H-chromen-6-yl]oxy]pyridine-2-carboxamide
CID 173129786
2-amino-3-methyl-N-[6-[[(2R)-2-phenyl-3,4-dihydro-2H-chromen-6-yl]oxy]-3-pyridinyl]butanamide;hydrochloride
CID 69015094
N-[(1,5-dimethylpyrazol-4-yl)methyl]-2-[[(2S)-2-(3-fluorophenyl)-3,4-dihydro-2H-chromen-6-yl]oxy]-1,3-thiazole-5-carboxamide
CID 154062093
(4S)-4-amino-5-oxo-5-[[6-[(2-phenyl-3,4-dihydro-2H-chromen-6-yl)oxy]-3-pyridinyl]amino]pentanoic acid
CID 69016616

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(3-fluorophenyl)-3,4-dihydro-2H-chromen-6-yl]oxy]pyridine?
The IUPAC name of 2-[[2-(3-fluorophenyl)-3,4-dihydro-2H-chromen-6-yl]oxy]pyridine (CID 142675808) is 2-[[2-(3-fluorophenyl)-3,4-dihydro-2H-chromen-6-yl]oxy]pyridine.
What is the SMILES notation for 2-[[2-(3-fluorophenyl)-3,4-dihydro-2H-chromen-6-yl]oxy]pyridine?
The canonical SMILES for 2-[[2-(3-fluorophenyl)-3,4-dihydro-2H-chromen-6-yl]oxy]pyridine is Fc1cccc(C2CCc3cc(Oc4ccccn4)ccc3O2)c1.
What is the InChIKey of 2-[[2-(3-fluorophenyl)-3,4-dihydro-2H-chromen-6-yl]oxy]pyridine?
The InChIKey is DHMRVQCJLWFBAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16FNO2/c21-16-5-3-4-14(12-16)18-9-7-15-13-17(8-10-19(15)24-18)23-20-6-1-2-11-22-20/h1-6,8,10-13,18H,7,9H2.
What are the key properties of 2-[[2-(3-fluorophenyl)-3,4-dihydro-2H-chromen-6-yl]oxy]pyridine?
2-[[2-(3-fluorophenyl)-3,4-dihydro-2H-chromen-6-yl]oxy]pyridine has a molecular weight of 321.35 g/mol, XLogP of 5.08, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(3-fluorophenyl)-3,4-dihydro-2H-chromen-6-yl]oxy]pyridine is sourced from PubChem (CID 142675808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).