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

C17H14FNO2 — CID 141170966

IUPAC3-[[4-[(4-fluorophenyl)methoxy]phenyl]methyl]-1,2-oxazole
SMILESFc1ccc(COc2ccc(Cc3ccon3)cc2)cc1
InChIInChI=1S/C17H14FNO2/c18-15-5-1-14(2-6-15)12-20-17-7-3-13(4-8-17)11-16-9-10-21-19-16/h1-10H,11-12H2
InChIKeyYGMDAIJAPGTFRU-UHFFFAOYSA-N
MW283.30 g/mol
LogP3.98
Rot. Bonds5

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

3-[[4-[(4-fluorophenyl)methoxy]phenyl]methyl]-1,2-oxazole (PubChem CID 141170966) has the molecular formula C17H14FNO2 and a molecular weight of 283.30 g/mol. Its IUPAC name is 3-[[4-[(4-fluorophenyl)methoxy]phenyl]methyl]-1,2-oxazole.

Molecular Properties

Compound Name3-[[4-[(4-fluorophenyl)methoxy]phenyl]methyl]-1,2-oxazole
PubChem CID141170966
Molecular FormulaC17H14FNO2
Molecular Weight283.30 g/mol
Exact Mass283.10
IUPAC Name3-[[4-[(4-fluorophenyl)methoxy]phenyl]methyl]-1,2-oxazole
SMILESFc1ccc(COc2ccc(Cc3ccon3)cc2)cc1
InChIInChI=1S/C17H14FNO2/c18-15-5-1-14(2-6-15)12-20-17-7-3-13(4-8-17)11-16-9-10-21-19-16/h1-10H,11-12H2
InChIKeyYGMDAIJAPGTFRU-UHFFFAOYSA-N
XLogP3.98
TPSA35.26 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.30
LogP ≤ 53.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-[[6-[(4-fluorophenyl)methoxy]-3-pyridinyl]methyl]-1,2-oxazole
CID 141170948
1-fluoro-4-[[4-[[4-[(4-fluorophenoxy)methyl]phenyl]methyl]phenyl]methoxy]benzene
CID 129203352
1-(chloromethyl)-4-[(4-fluorophenyl)methoxy]benzene
CID 22280023
1-fluoro-4-(phenoxymethyl)benzene
CID 957495
2-[4-(1,2-oxazol-3-ylmethoxy)phenyl]acetic acid
CID 117094930
2-[4-[(4-fluorophenoxy)methyl]phenyl]-N-methylpropan-1-amine
CID 105350603
4-[(4-fluorophenoxy)methyl]-1,2-oxazole
CID 61227729
(1R)-1-[4-[(4-fluorophenyl)methoxy]phenyl]ethanol
CID 63364366
acetaldehyde;4-[(4-fluorophenyl)methoxy]benzaldehyde
CID 175354116
5-cyclopropyl-3-[4-[(4-fluorophenyl)methoxy]phenyl]-1,2,4-oxadiazole
CID 42851402
3-[(4-fluorophenyl)methyl]-1,2,4-oxadiazole
CID 54362686
(4-fluorophenyl) 3-(1,2-oxazol-3-yl)propanoate
CID 174614806

Frequently Asked Questions

What is the IUPAC name of 3-[[4-[(4-fluorophenyl)methoxy]phenyl]methyl]-1,2-oxazole?
The IUPAC name of 3-[[4-[(4-fluorophenyl)methoxy]phenyl]methyl]-1,2-oxazole (CID 141170966) is 3-[[4-[(4-fluorophenyl)methoxy]phenyl]methyl]-1,2-oxazole.
What is the SMILES notation for 3-[[4-[(4-fluorophenyl)methoxy]phenyl]methyl]-1,2-oxazole?
The canonical SMILES for 3-[[4-[(4-fluorophenyl)methoxy]phenyl]methyl]-1,2-oxazole is Fc1ccc(COc2ccc(Cc3ccon3)cc2)cc1.
What is the InChIKey of 3-[[4-[(4-fluorophenyl)methoxy]phenyl]methyl]-1,2-oxazole?
The InChIKey is YGMDAIJAPGTFRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14FNO2/c18-15-5-1-14(2-6-15)12-20-17-7-3-13(4-8-17)11-16-9-10-21-19-16/h1-10H,11-12H2.
What are the key properties of 3-[[4-[(4-fluorophenyl)methoxy]phenyl]methyl]-1,2-oxazole?
3-[[4-[(4-fluorophenyl)methoxy]phenyl]methyl]-1,2-oxazole has a molecular weight of 283.30 g/mol, XLogP of 3.98, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[4-[(4-fluorophenyl)methoxy]phenyl]methyl]-1,2-oxazole is sourced from PubChem (CID 141170966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).