2-amino-1-[2-(4-fluorophenyl)-1,3-oxazol-4-yl]ethanol

C11H11FN2O2 — CID 67322495

IUPAC2-amino-1-[2-(4-fluorophenyl)-1,3-oxazol-4-yl]ethanol
SMILESNCC(O)c1coc(-c2ccc(F)cc2)n1
InChIInChI=1S/C11H11FN2O2/c12-8-3-1-7(2-4-8)11-14-9(6-16-11)10(15)5-13/h1-4,6,10,15H,5,13H2
InChIKeySHRCPUJCKSQWHV-UHFFFAOYSA-N
MW222.22 g/mol
LogP1.47
Rot. Bonds3

About 2-amino-1-[2-(4-fluorophenyl)-1,3-oxazol-4-yl]ethanol

2-amino-1-[2-(4-fluorophenyl)-1,3-oxazol-4-yl]ethanol (PubChem CID 67322495) has the molecular formula C11H11FN2O2 and a molecular weight of 222.22 g/mol. Its IUPAC name is 2-amino-1-[2-(4-fluorophenyl)-1,3-oxazol-4-yl]ethanol.

Molecular Properties

Compound Name2-amino-1-[2-(4-fluorophenyl)-1,3-oxazol-4-yl]ethanol
PubChem CID67322495
Molecular FormulaC11H11FN2O2
Molecular Weight222.22 g/mol
Exact Mass222.08
IUPAC Name2-amino-1-[2-(4-fluorophenyl)-1,3-oxazol-4-yl]ethanol
SMILESNCC(O)c1coc(-c2ccc(F)cc2)n1
InChIInChI=1S/C11H11FN2O2/c12-8-3-1-7(2-4-8)11-14-9(6-16-11)10(15)5-13/h1-4,6,10,15H,5,13H2
InChIKeySHRCPUJCKSQWHV-UHFFFAOYSA-N
XLogP1.47
TPSA72.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.22
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(4-Fluorophenyl)-1,3-oxazol-4-yl]acetic acid
CID 3244952
2-Phenyl-4-oxazolecarboxamide
CID 604678
N-cyclohexyl-2-[2-(4-fluorophenyl)-1,3-oxazol-4-yl]acetamide
CID 3239761
N-benzyl-2-[2-(4-fluorophenyl)-1,3-oxazol-4-yl]acetamide
CID 3243889
4-{[2-(4-Fluorophenyl)-1,3-oxazol-4-yl]acetyl}morpholine
CID 3244402
N-[2-[2-(4-fluorophenyl)-1,3-oxazol-4-yl]ethyl]-2-methylpiperidine-1-carboxamide
CID 53610188
Ethyl 2-phenyl-1,3-oxazole-4-carboxylate
CID 571056
2-Phenyl-oxazole-4-carboxylic acid
CID 1234752
4-Methyl-2-phenyl-1,3-oxazole
CID 594333
Benzyl 2-(3-fluorophenyl)oxazole-4-carboxylate
CID 46201705
2-((3-((2-(4-Fluorophenyl)oxazol-4-yl)methoxy)benzyl)(methoxycarbonyl)amino)acetic acid
CID 46888966
N,N-dipentyl-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
CID 54577603

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-[2-(4-fluorophenyl)-1,3-oxazol-4-yl]ethanol?
The IUPAC name of 2-amino-1-[2-(4-fluorophenyl)-1,3-oxazol-4-yl]ethanol (CID 67322495) is 2-amino-1-[2-(4-fluorophenyl)-1,3-oxazol-4-yl]ethanol.
What is the SMILES notation for 2-amino-1-[2-(4-fluorophenyl)-1,3-oxazol-4-yl]ethanol?
The canonical SMILES for 2-amino-1-[2-(4-fluorophenyl)-1,3-oxazol-4-yl]ethanol is NCC(O)c1coc(-c2ccc(F)cc2)n1.
What is the InChIKey of 2-amino-1-[2-(4-fluorophenyl)-1,3-oxazol-4-yl]ethanol?
The InChIKey is SHRCPUJCKSQWHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11FN2O2/c12-8-3-1-7(2-4-8)11-14-9(6-16-11)10(15)5-13/h1-4,6,10,15H,5,13H2.
What are the key properties of 2-amino-1-[2-(4-fluorophenyl)-1,3-oxazol-4-yl]ethanol?
2-amino-1-[2-(4-fluorophenyl)-1,3-oxazol-4-yl]ethanol has a molecular weight of 222.22 g/mol, XLogP of 1.47, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-[2-(4-fluorophenyl)-1,3-oxazol-4-yl]ethanol is sourced from PubChem (CID 67322495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).