2-(4-fluorophenyl)-5-methyl-2,3-dihydro-1,3-oxazole

C10H10FNO — CID 22563369

IUPAC2-(4-fluorophenyl)-5-methyl-2,3-dihydro-1,3-oxazole
SMILESCC1=CNC(c2ccc(F)cc2)O1
InChIInChI=1S/C10H10FNO/c1-7-6-12-10(13-7)8-2-4-9(11)5-3-8/h2-6,10,12H,1H3
InChIKeyCRRFGMJAAPLKPJ-UHFFFAOYSA-N
MW179.19 g/mol
LogP2.31
Rot. Bonds1

About 2-(4-fluorophenyl)-5-methyl-2,3-dihydro-1,3-oxazole

2-(4-fluorophenyl)-5-methyl-2,3-dihydro-1,3-oxazole (PubChem CID 22563369) has the molecular formula C10H10FNO and a molecular weight of 179.19 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-5-methyl-2,3-dihydro-1,3-oxazole.

Molecular Properties

Compound Name2-(4-fluorophenyl)-5-methyl-2,3-dihydro-1,3-oxazole
PubChem CID22563369
Molecular FormulaC10H10FNO
Molecular Weight179.19 g/mol
Exact Mass179.07
IUPAC Name2-(4-fluorophenyl)-5-methyl-2,3-dihydro-1,3-oxazole
SMILESCC1=CNC(c2ccc(F)cc2)O1
InChIInChI=1S/C10H10FNO/c1-7-6-12-10(13-7)8-2-4-9(11)5-3-8/h2-6,10,12H,1H3
InChIKeyCRRFGMJAAPLKPJ-UHFFFAOYSA-N
XLogP2.31
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.19
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Oxazolidine, 2-phenyl-
CID 347092
Oxazolidine, 2-(p-fluorophenyl)-3-methyl-
CID 3051655
Oxazolidine, 2-(m-fluorophenyl)-3-methyl-
CID 3051656
Oxazolidine, 2-methyl-2-phenyl-
CID 278954
4,4-Dimethyl-2-phenyl-1,3-oxazolidine
CID 589827
Fluorophenyloxazolidine
CID 153639051
O-benzyl N-[(4-fluorophenyl)methyl]carbamothioate
CID 178336430
2H-1,3-Oxazine, tetrahydro-2-phenyl-
CID 352488
2-(3-Methyl-5-phenyloxazolyl) benzene
CID 14031387
2-Phenyldihydrooxazole
CID 18505521
Methoxy-dihydroisoquinoline
CID 70426915
2,2-Diphenyloxazole
CID 129720265

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-5-methyl-2,3-dihydro-1,3-oxazole?
The IUPAC name of 2-(4-fluorophenyl)-5-methyl-2,3-dihydro-1,3-oxazole (CID 22563369) is 2-(4-fluorophenyl)-5-methyl-2,3-dihydro-1,3-oxazole.
What is the SMILES notation for 2-(4-fluorophenyl)-5-methyl-2,3-dihydro-1,3-oxazole?
The canonical SMILES for 2-(4-fluorophenyl)-5-methyl-2,3-dihydro-1,3-oxazole is CC1=CNC(c2ccc(F)cc2)O1.
What is the InChIKey of 2-(4-fluorophenyl)-5-methyl-2,3-dihydro-1,3-oxazole?
The InChIKey is CRRFGMJAAPLKPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FNO/c1-7-6-12-10(13-7)8-2-4-9(11)5-3-8/h2-6,10,12H,1H3.
What are the key properties of 2-(4-fluorophenyl)-5-methyl-2,3-dihydro-1,3-oxazole?
2-(4-fluorophenyl)-5-methyl-2,3-dihydro-1,3-oxazole has a molecular weight of 179.19 g/mol, XLogP of 2.31, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-5-methyl-2,3-dihydro-1,3-oxazole is sourced from PubChem (CID 22563369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).