4-(fluoromethyl)-3-phenyl-1,2-oxazole

C10H8FNO — CID 141159129

IUPAC4-(fluoromethyl)-3-phenyl-1,2-oxazole
SMILESFCc1conc1-c1ccccc1
InChIInChI=1S/C10H8FNO/c11-6-9-7-13-12-10(9)8-4-2-1-3-5-8/h1-5,7H,6H2
InChIKeySPZAFHFELDECMS-UHFFFAOYSA-N
MW177.18 g/mol
LogP2.81
Rot. Bonds2

About 4-(fluoromethyl)-3-phenyl-1,2-oxazole

4-(fluoromethyl)-3-phenyl-1,2-oxazole (PubChem CID 141159129) has the molecular formula C10H8FNO and a molecular weight of 177.18 g/mol. Its IUPAC name is 4-(fluoromethyl)-3-phenyl-1,2-oxazole.

Molecular Properties

Compound Name4-(fluoromethyl)-3-phenyl-1,2-oxazole
PubChem CID141159129
Molecular FormulaC10H8FNO
Molecular Weight177.18 g/mol
Exact Mass177.06
IUPAC Name4-(fluoromethyl)-3-phenyl-1,2-oxazole
SMILESFCc1conc1-c1ccccc1
InChIInChI=1S/C10H8FNO/c11-6-9-7-13-12-10(9)8-4-2-1-3-5-8/h1-5,7H,6H2
InChIKeySPZAFHFELDECMS-UHFFFAOYSA-N
XLogP2.81
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.18
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-butyl-3-phenyl-1,2-oxazole
CID 20616768
3-phenyl-1,2-oxazole-4-thiol
CID 150967466
3-(3-phenyl-1,2-oxazol-4-yl)-1-pyrrolidin-1-ylpropan-1-one
CID 71839862
2-[3-(3-bromophenyl)-1,2-oxazol-4-yl]acetic acid
CID 82307329
2-(3-pyridin-3-yl-1,2-oxazol-4-yl)ethanamine
CID 82281197
N-[(2-chloro-4-fluorophenyl)methyl]-3-(3-phenyl-1,2-oxazol-4-yl)propanamide
CID 71839873
4-[4-(2-hydroxyethyl)-1,2-oxazol-3-yl]benzoic acid
CID 10014196
ethyl 3-phenyl-1,2-oxazole-4-carboxylate
CID 871048
3-[2,3-bis(4-phenyl-1,2-oxazol-3-yl)phenyl]-4-phenyl-1,2-oxazole
CID 91007673
[3-(4-propan-2-ylphenyl)-1,2-oxazol-4-yl]methanamine
CID 82284911
2-[3-(3-ethoxyphenyl)-1,2-oxazol-4-yl]acetic acid
CID 82295657
3-phenyl-N-(2-phenylethyl)-1,2-oxazole-4-carboxamide
CID 100771698

Frequently Asked Questions

What is the IUPAC name of 4-(fluoromethyl)-3-phenyl-1,2-oxazole?
The IUPAC name of 4-(fluoromethyl)-3-phenyl-1,2-oxazole (CID 141159129) is 4-(fluoromethyl)-3-phenyl-1,2-oxazole.
What is the SMILES notation for 4-(fluoromethyl)-3-phenyl-1,2-oxazole?
The canonical SMILES for 4-(fluoromethyl)-3-phenyl-1,2-oxazole is FCc1conc1-c1ccccc1.
What is the InChIKey of 4-(fluoromethyl)-3-phenyl-1,2-oxazole?
The InChIKey is SPZAFHFELDECMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8FNO/c11-6-9-7-13-12-10(9)8-4-2-1-3-5-8/h1-5,7H,6H2.
What are the key properties of 4-(fluoromethyl)-3-phenyl-1,2-oxazole?
4-(fluoromethyl)-3-phenyl-1,2-oxazole has a molecular weight of 177.18 g/mol, XLogP of 2.81, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(fluoromethyl)-3-phenyl-1,2-oxazole is sourced from PubChem (CID 141159129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).