3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(3-methylphenyl)propanamide

C19H17FN2O2 — CID 17440612

IUPAC3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(3-methylphenyl)propanamide
SMILESCc1cccc(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)c1
InChIInChI=1S/C19H17FN2O2/c1-13-3-2-4-16(11-13)22-18(23)9-10-19-21-12-17(24-19)14-5-7-15(20)8-6-14/h2-8,11-12H,9-10H2,1H3,(H,22,23)
InChIKeyQLJCRRMXKWOPEE-UHFFFAOYSA-N
MW324.36 g/mol
LogP4.36
Rot. Bonds5

About 3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(3-methylphenyl)propanamide

3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(3-methylphenyl)propanamide (PubChem CID 17440612) has the molecular formula C19H17FN2O2 and a molecular weight of 324.36 g/mol. Its IUPAC name is 3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(3-methylphenyl)propanamide.

Molecular Properties

Compound Name3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(3-methylphenyl)propanamide
PubChem CID17440612
Molecular FormulaC19H17FN2O2
Molecular Weight324.36 g/mol
Exact Mass324.13
IUPAC Name3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(3-methylphenyl)propanamide
SMILESCc1cccc(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)c1
InChIInChI=1S/C19H17FN2O2/c1-13-3-2-4-16(11-13)22-18(23)9-10-19-21-12-17(24-19)14-5-7-15(20)8-6-14/h2-8,11-12H,9-10H2,1H3,(H,22,23)
InChIKeyQLJCRRMXKWOPEE-UHFFFAOYSA-N
XLogP4.36
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.36
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(3-methylphenyl)propanamide?
The IUPAC name of 3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(3-methylphenyl)propanamide (CID 17440612) is 3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(3-methylphenyl)propanamide.
What is the SMILES notation for 3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(3-methylphenyl)propanamide?
The canonical SMILES for 3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(3-methylphenyl)propanamide is Cc1cccc(NC(=O)CCc2ncc(-c3ccc(F)cc3)o2)c1.
What is the InChIKey of 3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(3-methylphenyl)propanamide?
The InChIKey is QLJCRRMXKWOPEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17FN2O2/c1-13-3-2-4-16(11-13)22-18(23)9-10-19-21-12-17(24-19)14-5-7-15(20)8-6-14/h2-8,11-12H,9-10H2,1H3,(H,22,23).
What are the key properties of 3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(3-methylphenyl)propanamide?
3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(3-methylphenyl)propanamide has a molecular weight of 324.36 g/mol, XLogP of 4.36, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(3-methylphenyl)propanamide is sourced from PubChem (CID 17440612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).