N-[1-(4-fluorophenyl)propyl]-2-(4-methyl-1,2,5-oxadiazol-3-yl)acetamide

C14H16FN3O2 — CID 110225958

IUPACN-[1-(4-fluorophenyl)propyl]-2-(4-methyl-1,2,5-oxadiazol-3-yl)acetamide
SMILESCCC(NC(=O)Cc1nonc1C)c1ccc(F)cc1
InChIInChI=1S/C14H16FN3O2/c1-3-12(10-4-6-11(15)7-5-10)16-14(19)8-13-9(2)17-20-18-13/h4-7,12H,3,8H2,1-2H3,(H,16,19)
InChIKeyWSDYYCDHKBNNCN-UHFFFAOYSA-N
MW277.30 g/mol
LogP2.33
Rot. Bonds5

About N-[1-(4-fluorophenyl)propyl]-2-(4-methyl-1,2,5-oxadiazol-3-yl)acetamide

N-[1-(4-fluorophenyl)propyl]-2-(4-methyl-1,2,5-oxadiazol-3-yl)acetamide (PubChem CID 110225958) has the molecular formula C14H16FN3O2 and a molecular weight of 277.30 g/mol. Its IUPAC name is N-[1-(4-fluorophenyl)propyl]-2-(4-methyl-1,2,5-oxadiazol-3-yl)acetamide.

Molecular Properties

Compound NameN-[1-(4-fluorophenyl)propyl]-2-(4-methyl-1,2,5-oxadiazol-3-yl)acetamide
PubChem CID110225958
Molecular FormulaC14H16FN3O2
Molecular Weight277.30 g/mol
Exact Mass277.12
IUPAC NameN-[1-(4-fluorophenyl)propyl]-2-(4-methyl-1,2,5-oxadiazol-3-yl)acetamide
SMILESCCC(NC(=O)Cc1nonc1C)c1ccc(F)cc1
InChIInChI=1S/C14H16FN3O2/c1-3-12(10-4-6-11(15)7-5-10)16-14(19)8-13-9(2)17-20-18-13/h4-7,12H,3,8H2,1-2H3,(H,16,19)
InChIKeyWSDYYCDHKBNNCN-UHFFFAOYSA-N
XLogP2.33
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.30
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-(4-fluorophenyl)propyl]-2-(4-methyl-1,2,5-oxadiazol-3-yl)acetamide?
The IUPAC name of N-[1-(4-fluorophenyl)propyl]-2-(4-methyl-1,2,5-oxadiazol-3-yl)acetamide (CID 110225958) is N-[1-(4-fluorophenyl)propyl]-2-(4-methyl-1,2,5-oxadiazol-3-yl)acetamide.
What is the SMILES notation for N-[1-(4-fluorophenyl)propyl]-2-(4-methyl-1,2,5-oxadiazol-3-yl)acetamide?
The canonical SMILES for N-[1-(4-fluorophenyl)propyl]-2-(4-methyl-1,2,5-oxadiazol-3-yl)acetamide is CCC(NC(=O)Cc1nonc1C)c1ccc(F)cc1.
What is the InChIKey of N-[1-(4-fluorophenyl)propyl]-2-(4-methyl-1,2,5-oxadiazol-3-yl)acetamide?
The InChIKey is WSDYYCDHKBNNCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FN3O2/c1-3-12(10-4-6-11(15)7-5-10)16-14(19)8-13-9(2)17-20-18-13/h4-7,12H,3,8H2,1-2H3,(H,16,19).
What are the key properties of N-[1-(4-fluorophenyl)propyl]-2-(4-methyl-1,2,5-oxadiazol-3-yl)acetamide?
N-[1-(4-fluorophenyl)propyl]-2-(4-methyl-1,2,5-oxadiazol-3-yl)acetamide has a molecular weight of 277.30 g/mol, XLogP of 2.33, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-fluorophenyl)propyl]-2-(4-methyl-1,2,5-oxadiazol-3-yl)acetamide is sourced from PubChem (CID 110225958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).