3-[[6-[(4-fluorophenyl)methoxy]-3-pyridinyl]methyl]-1,2-oxazole

C16H13FN2O2 — CID 141170948

IUPAC3-[[6-[(4-fluorophenyl)methoxy]-3-pyridinyl]methyl]-1,2-oxazole
SMILESFc1ccc(COc2ccc(Cc3ccon3)cn2)cc1
InChIInChI=1S/C16H13FN2O2/c17-14-4-1-12(2-5-14)11-20-16-6-3-13(10-18-16)9-15-7-8-21-19-15/h1-8,10H,9,11H2
InChIKeyLMSPZIOHNPCBAR-UHFFFAOYSA-N
MW284.29 g/mol
LogP3.38
Rot. Bonds5

About 3-[[6-[(4-fluorophenyl)methoxy]-3-pyridinyl]methyl]-1,2-oxazole

3-[[6-[(4-fluorophenyl)methoxy]-3-pyridinyl]methyl]-1,2-oxazole (PubChem CID 141170948) has the molecular formula C16H13FN2O2 and a molecular weight of 284.29 g/mol. Its IUPAC name is 3-[[6-[(4-fluorophenyl)methoxy]-3-pyridinyl]methyl]-1,2-oxazole.

Molecular Properties

Compound Name3-[[6-[(4-fluorophenyl)methoxy]-3-pyridinyl]methyl]-1,2-oxazole
PubChem CID141170948
Molecular FormulaC16H13FN2O2
Molecular Weight284.29 g/mol
Exact Mass284.10
IUPAC Name3-[[6-[(4-fluorophenyl)methoxy]-3-pyridinyl]methyl]-1,2-oxazole
SMILESFc1ccc(COc2ccc(Cc3ccon3)cn2)cc1
InChIInChI=1S/C16H13FN2O2/c17-14-4-1-12(2-5-14)11-20-16-6-3-13(10-18-16)9-15-7-8-21-19-15/h1-8,10H,9,11H2
InChIKeyLMSPZIOHNPCBAR-UHFFFAOYSA-N
XLogP3.38
TPSA48.15 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.29
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-[[4-[(4-fluorophenyl)methoxy]phenyl]methyl]-1,2-oxazole
CID 141170966
[6-[(4-fluorophenyl)methoxy]-3-pyridinyl]methanamine
CID 146194190
methyl 6-[(4-fluorophenyl)methoxy]pyridine-3-carboxylate
CID 58368225
[2-[(4-fluorophenyl)methoxy]-4-pyridinyl]methanamine
CID 69248069
5-bromo-2-[(4-fluorophenyl)methoxy]pyridine;5-bromo-2-fluoropyridine;(4-fluorophenyl)methanol
CID 159925318
1-fluoro-4-[[4-[[4-[(4-fluorophenoxy)methyl]phenyl]methyl]phenyl]methoxy]benzene
CID 129203352
3-[(4-fluorophenyl)methyl]-1,2,4-oxadiazole
CID 54362686
5-fluoro-N-(1,2-oxazol-3-ylmethyl)pyrimidin-2-amine
CID 115750236
3-benzyl-1,2-oxazole;carbonyl dichloride
CID 21092925
1-(6-phenylmethoxy-3-pyridinyl)propan-2-amine
CID 71131754
2-[(4-fluorophenyl)methoxy]pyrimidine
CID 126953834
6-[2-(4-fluorophenyl)ethoxy]pyridin-3-amine
CID 20535524

Frequently Asked Questions

What is the IUPAC name of 3-[[6-[(4-fluorophenyl)methoxy]-3-pyridinyl]methyl]-1,2-oxazole?
The IUPAC name of 3-[[6-[(4-fluorophenyl)methoxy]-3-pyridinyl]methyl]-1,2-oxazole (CID 141170948) is 3-[[6-[(4-fluorophenyl)methoxy]-3-pyridinyl]methyl]-1,2-oxazole.
What is the SMILES notation for 3-[[6-[(4-fluorophenyl)methoxy]-3-pyridinyl]methyl]-1,2-oxazole?
The canonical SMILES for 3-[[6-[(4-fluorophenyl)methoxy]-3-pyridinyl]methyl]-1,2-oxazole is Fc1ccc(COc2ccc(Cc3ccon3)cn2)cc1.
What is the InChIKey of 3-[[6-[(4-fluorophenyl)methoxy]-3-pyridinyl]methyl]-1,2-oxazole?
The InChIKey is LMSPZIOHNPCBAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13FN2O2/c17-14-4-1-12(2-5-14)11-20-16-6-3-13(10-18-16)9-15-7-8-21-19-15/h1-8,10H,9,11H2.
What are the key properties of 3-[[6-[(4-fluorophenyl)methoxy]-3-pyridinyl]methyl]-1,2-oxazole?
3-[[6-[(4-fluorophenyl)methoxy]-3-pyridinyl]methyl]-1,2-oxazole has a molecular weight of 284.29 g/mol, XLogP of 3.38, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[6-[(4-fluorophenyl)methoxy]-3-pyridinyl]methyl]-1,2-oxazole is sourced from PubChem (CID 141170948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).