3-[2-(2-fluorophenoxy)ethyl]-1,2-oxazol-5-amine

C11H11FN2O2 — CID 82080194

IUPAC3-[2-(2-fluorophenoxy)ethyl]-1,2-oxazol-5-amine
SMILESNc1cc(CCOc2ccccc2F)no1
InChIInChI=1S/C11H11FN2O2/c12-9-3-1-2-4-10(9)15-6-5-8-7-11(13)16-14-8/h1-4,7H,5-6,13H2
InChIKeyFXDCTYKQNLXFEP-UHFFFAOYSA-N
MW222.22 g/mol
LogP2.02
Rot. Bonds4

About 3-[2-(2-fluorophenoxy)ethyl]-1,2-oxazol-5-amine

3-[2-(2-fluorophenoxy)ethyl]-1,2-oxazol-5-amine (PubChem CID 82080194) has the molecular formula C11H11FN2O2 and a molecular weight of 222.22 g/mol. Its IUPAC name is 3-[2-(2-fluorophenoxy)ethyl]-1,2-oxazol-5-amine.

Molecular Properties

Compound Name3-[2-(2-fluorophenoxy)ethyl]-1,2-oxazol-5-amine
PubChem CID82080194
Molecular FormulaC11H11FN2O2
Molecular Weight222.22 g/mol
Exact Mass222.08
IUPAC Name3-[2-(2-fluorophenoxy)ethyl]-1,2-oxazol-5-amine
SMILESNc1cc(CCOc2ccccc2F)no1
InChIInChI=1S/C11H11FN2O2/c12-9-3-1-2-4-10(9)15-6-5-8-7-11(13)16-14-8/h1-4,7H,5-6,13H2
InChIKeyFXDCTYKQNLXFEP-UHFFFAOYSA-N
XLogP2.02
TPSA61.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.22
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[(2,4-difluorophenoxy)methyl]-1,2-oxazol-5-amine
CID 82080942
2-[2-(2-fluorophenoxy)ethyl]pyridine
CID 64765449
2-[2-(2-fluorophenoxy)ethyl]thiophene
CID 64764713
4,6-dichloro-2-[2-(2-fluorophenoxy)ethyl]pyrimidine
CID 82169669
3-(3-aminopropyl)-1,2-oxazol-5-amine
CID 83845440
O-[2-(2-fluorophenoxy)ethyl]hydroxylamine
CID 11019312
1-fluoro-2-(2-iodoethoxy)benzene
CID 64787952
2-(2-fluorophenoxy)ethylhydrazine
CID 82125131
4-[(2-fluorophenoxy)methyl]-4,5-dihydro-1,3-oxazol-2-amine
CID 68713067
4-[2-(2-fluorophenoxy)ethyl]phenol
CID 154643282
4-amino-2-[2-(2-fluorophenoxy)ethyl]pyrimidine-5-carbonitrile
CID 82168405
3-(2-fluorophenoxy)propane-1-thiol
CID 79001947

Frequently Asked Questions

What is the IUPAC name of 3-[2-(2-fluorophenoxy)ethyl]-1,2-oxazol-5-amine?
The IUPAC name of 3-[2-(2-fluorophenoxy)ethyl]-1,2-oxazol-5-amine (CID 82080194) is 3-[2-(2-fluorophenoxy)ethyl]-1,2-oxazol-5-amine.
What is the SMILES notation for 3-[2-(2-fluorophenoxy)ethyl]-1,2-oxazol-5-amine?
The canonical SMILES for 3-[2-(2-fluorophenoxy)ethyl]-1,2-oxazol-5-amine is Nc1cc(CCOc2ccccc2F)no1.
What is the InChIKey of 3-[2-(2-fluorophenoxy)ethyl]-1,2-oxazol-5-amine?
The InChIKey is FXDCTYKQNLXFEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11FN2O2/c12-9-3-1-2-4-10(9)15-6-5-8-7-11(13)16-14-8/h1-4,7H,5-6,13H2.
What are the key properties of 3-[2-(2-fluorophenoxy)ethyl]-1,2-oxazol-5-amine?
3-[2-(2-fluorophenoxy)ethyl]-1,2-oxazol-5-amine has a molecular weight of 222.22 g/mol, XLogP of 2.02, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(2-fluorophenoxy)ethyl]-1,2-oxazol-5-amine is sourced from PubChem (CID 82080194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).