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

C11H11FN4O2 — CID 134148049

IUPAC2-amino-N-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]acetamide
SMILESNCC(=O)NCc1nnc(-c2ccc(F)cc2)o1
InChIInChI=1S/C11H11FN4O2/c12-8-3-1-7(2-4-8)11-16-15-10(18-11)6-14-9(17)5-13/h1-4H,5-6,13H2,(H,14,17)
InChIKeyDFEYQJOSFPKOEP-UHFFFAOYSA-N
MW250.23 g/mol
LogP0.45
Rot. Bonds4

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

2-amino-N-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]acetamide (PubChem CID 134148049) has the molecular formula C11H11FN4O2 and a molecular weight of 250.23 g/mol. Its IUPAC name is 2-amino-N-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]acetamide
PubChem CID134148049
Molecular FormulaC11H11FN4O2
Molecular Weight250.23 g/mol
Exact Mass250.09
IUPAC Name2-amino-N-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]acetamide
SMILESNCC(=O)NCc1nnc(-c2ccc(F)cc2)o1
InChIInChI=1S/C11H11FN4O2/c12-8-3-1-7(2-4-8)11-16-15-10(18-11)6-14-9(17)5-13/h1-4H,5-6,13H2,(H,14,17)
InChIKeyDFEYQJOSFPKOEP-UHFFFAOYSA-N
XLogP0.45
TPSA94.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.23
LogP ≤ 50.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]acetamide?
The IUPAC name of 2-amino-N-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]acetamide (CID 134148049) is 2-amino-N-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]acetamide.
What is the SMILES notation for 2-amino-N-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]acetamide?
The canonical SMILES for 2-amino-N-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]acetamide is NCC(=O)NCc1nnc(-c2ccc(F)cc2)o1.
What is the InChIKey of 2-amino-N-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]acetamide?
The InChIKey is DFEYQJOSFPKOEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11FN4O2/c12-8-3-1-7(2-4-8)11-16-15-10(18-11)6-14-9(17)5-13/h1-4H,5-6,13H2,(H,14,17).
What are the key properties of 2-amino-N-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]acetamide?
2-amino-N-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]acetamide has a molecular weight of 250.23 g/mol, XLogP of 0.45, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]acetamide is sourced from PubChem (CID 134148049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).