N-benzyl-3-[3-(3-fluorophenyl)-1,2-oxazol-4-yl]propanamide

C19H17FN2O2 — CID 53161773

IUPACN-benzyl-3-[3-(3-fluorophenyl)-1,2-oxazol-4-yl]propanamide
SMILESO=C(CCc1conc1-c1cccc(F)c1)NCc1ccccc1
InChIInChI=1S/C19H17FN2O2/c20-17-8-4-7-15(11-17)19-16(13-24-22-19)9-10-18(23)21-12-14-5-2-1-3-6-14/h1-8,11,13H,9-10,12H2,(H,21,23)
InChIKeyLMMDQLSRSBTTNW-UHFFFAOYSA-N
MW324.36 g/mol
LogP3.73
Rot. Bonds6

About N-benzyl-3-[3-(3-fluorophenyl)-1,2-oxazol-4-yl]propanamide

N-benzyl-3-[3-(3-fluorophenyl)-1,2-oxazol-4-yl]propanamide (PubChem CID 53161773) has the molecular formula C19H17FN2O2 and a molecular weight of 324.36 g/mol. Its IUPAC name is N-benzyl-3-[3-(3-fluorophenyl)-1,2-oxazol-4-yl]propanamide.

Molecular Properties

Compound NameN-benzyl-3-[3-(3-fluorophenyl)-1,2-oxazol-4-yl]propanamide
PubChem CID53161773
Molecular FormulaC19H17FN2O2
Molecular Weight324.36 g/mol
Exact Mass324.13
IUPAC NameN-benzyl-3-[3-(3-fluorophenyl)-1,2-oxazol-4-yl]propanamide
SMILESO=C(CCc1conc1-c1cccc(F)c1)NCc1ccccc1
InChIInChI=1S/C19H17FN2O2/c20-17-8-4-7-15(11-17)19-16(13-24-22-19)9-10-18(23)21-12-14-5-2-1-3-6-14/h1-8,11,13H,9-10,12H2,(H,21,23)
InChIKeyLMMDQLSRSBTTNW-UHFFFAOYSA-N
XLogP3.73
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.36
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-benzyl-3-[3-(3-fluorophenyl)-1,2-oxazol-4-yl]propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(2-chlorophenyl)methyl]-3-[3-(3-fluorophenyl)-1,2-oxazol-4-yl]propanamide
CID 53161786
N-(cyclopropylmethyl)-3-[3-(3-fluorophenyl)-1,2-oxazol-4-yl]propanamide
CID 53161791
N-[(2-chloro-4-fluorophenyl)methyl]-3-(3-phenyl-1,2-oxazol-4-yl)propanamide
CID 71839873
3-(3-phenyl-1,2-oxazol-4-yl)-N-[(4-propan-2-ylphenyl)methyl]propanamide
CID 71839854
N-[(4-chlorophenyl)methyl]-3-[3-(3-methylphenyl)-1,2-oxazol-4-yl]propanamide
CID 71839812
N-[(4-chlorophenyl)methyl]-3-[3-(4-fluorophenyl)-1,2-oxazol-4-yl]propanamide
CID 71839779
N-[(4-methylphenyl)methyl]-3-[3-(4-methylphenyl)-1,2-oxazol-4-yl]propanamide
CID 71839834
N-[(2-methylphenyl)methyl]-3-[3-(3-methylphenyl)-1,2-oxazol-4-yl]propanamide
CID 71839806
3-[3-(4-fluorophenyl)-1,2-oxazol-4-yl]-N-[(4-propan-2-ylphenyl)methyl]propanamide
CID 71839755
N-[(2,5-dimethylphenyl)methyl]-3-[3-(3-methylphenyl)-1,2-oxazol-4-yl]propanamide
CID 71839791
N-[(4-fluorophenyl)methyl]-3-[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]propanamide
CID 71821682
N-(cyclohexylmethyl)-3-(3-phenyl-1,2-oxazol-4-yl)propanamide
CID 71839867

Frequently Asked Questions

What is the IUPAC name of N-benzyl-3-[3-(3-fluorophenyl)-1,2-oxazol-4-yl]propanamide?
The IUPAC name of N-benzyl-3-[3-(3-fluorophenyl)-1,2-oxazol-4-yl]propanamide (CID 53161773) is N-benzyl-3-[3-(3-fluorophenyl)-1,2-oxazol-4-yl]propanamide.
What is the SMILES notation for N-benzyl-3-[3-(3-fluorophenyl)-1,2-oxazol-4-yl]propanamide?
The canonical SMILES for N-benzyl-3-[3-(3-fluorophenyl)-1,2-oxazol-4-yl]propanamide is O=C(CCc1conc1-c1cccc(F)c1)NCc1ccccc1.
What is the InChIKey of N-benzyl-3-[3-(3-fluorophenyl)-1,2-oxazol-4-yl]propanamide?
The InChIKey is LMMDQLSRSBTTNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17FN2O2/c20-17-8-4-7-15(11-17)19-16(13-24-22-19)9-10-18(23)21-12-14-5-2-1-3-6-14/h1-8,11,13H,9-10,12H2,(H,21,23).
What are the key properties of N-benzyl-3-[3-(3-fluorophenyl)-1,2-oxazol-4-yl]propanamide?
N-benzyl-3-[3-(3-fluorophenyl)-1,2-oxazol-4-yl]propanamide has a molecular weight of 324.36 g/mol, XLogP of 3.73, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-3-[3-(3-fluorophenyl)-1,2-oxazol-4-yl]propanamide is sourced from PubChem (CID 53161773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).