2-[5-[(E)-2-cyclohexyl-1-fluoroethenyl]-1,2,4-oxadiazol-3-yl]-N-cyclopentylacetamide

C17H24FN3O2 — CID 138041785

IUPAC2-[5-[(E)-2-cyclohexyl-1-fluoroethenyl]-1,2,4-oxadiazol-3-yl]-N-cyclopentylacetamide
SMILESO=C(Cc1noc(/C(F)=C\C2CCCCC2)n1)NC1CCCC1
InChIInChI=1S/C17H24FN3O2/c18-14(10-12-6-2-1-3-7-12)17-20-15(21-23-17)11-16(22)19-13-8-4-5-9-13/h10,12-13H,1-9,11H2,(H,19,22)/b14-10+
InChIKeyUDCPOLFACKCGRN-GXDHUFHOSA-N
MW321.40 g/mol
LogP3.56
Rot. Bonds5

About 2-[5-[(E)-2-cyclohexyl-1-fluoroethenyl]-1,2,4-oxadiazol-3-yl]-N-cyclopentylacetamide

2-[5-[(E)-2-cyclohexyl-1-fluoroethenyl]-1,2,4-oxadiazol-3-yl]-N-cyclopentylacetamide (PubChem CID 138041785) has the molecular formula C17H24FN3O2 and a molecular weight of 321.40 g/mol. Its IUPAC name is 2-[5-[(E)-2-cyclohexyl-1-fluoroethenyl]-1,2,4-oxadiazol-3-yl]-N-cyclopentylacetamide.

Molecular Properties

Compound Name2-[5-[(E)-2-cyclohexyl-1-fluoroethenyl]-1,2,4-oxadiazol-3-yl]-N-cyclopentylacetamide
PubChem CID138041785
Molecular FormulaC17H24FN3O2
Molecular Weight321.40 g/mol
Exact Mass321.19
IUPAC Name2-[5-[(E)-2-cyclohexyl-1-fluoroethenyl]-1,2,4-oxadiazol-3-yl]-N-cyclopentylacetamide
SMILESO=C(Cc1noc(/C(F)=C\C2CCCCC2)n1)NC1CCCC1
InChIInChI=1S/C17H24FN3O2/c18-14(10-12-6-2-1-3-7-12)17-20-15(21-23-17)11-16(22)19-13-8-4-5-9-13/h10,12-13H,1-9,11H2,(H,19,22)/b14-10+
InChIKeyUDCPOLFACKCGRN-GXDHUFHOSA-N
XLogP3.56
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.40
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopentyl-2-[5-(2-hydroxy-3-methylbutyl)-1,2,4-oxadiazol-3-yl]acetamide
CID 86801808
N-cyclopentyl-2-[5-[(2S)-2-hydroxy-3-methylbutyl]-1,2,4-oxadiazol-3-yl]acetamide
CID 99716263
N-cyclohexyl-2-[5-[(2S)-morpholin-2-yl]-1,2,4-oxadiazol-3-yl]acetamide
CID 120835213
N-cyclopentyl-3-[2-oxo-2-[3-(trifluoromethyl)anilino]ethyl]-1,2,4-oxadiazole-5-carboxamide
CID 39340819
N-cyclohexyl-2-[5-[2-(cyclopropylmethyl)-1,3-oxazol-4-yl]-1,2,4-oxadiazol-3-yl]acetamide
CID 100643670
2-[5-[(3aS,6aS)-2,3,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-3a-yl]-1,2,4-oxadiazol-3-yl]-N-cyclohexylacetamide;hydrochloride
CID 120835182
N-cyclopentyl-2-(3-methyl-1,2,4-oxadiazol-5-yl)acetamide
CID 110677317
N-cyclohexyl-2-[5-(2,5-dioxaspiro[3.5]non-7-en-7-yl)-1,2,4-oxadiazol-3-yl]acetamide
CID 167951534
N-cycloheptyl-N'-cyclopentylpropanediamide
CID 108942189
2-[5-[(1R,2R)-2-(2-chlorophenyl)cyclopropyl]-1,2,4-oxadiazol-3-yl]-N-cyclopentylacetamide
CID 95899316
2-[5-[2-(2-chlorophenyl)cyclopropyl]-1,2,4-oxadiazol-3-yl]-N-cyclopentylacetamide
CID 71876197
2-(5-cycloheptyl-1,2,4-oxadiazol-3-yl)-N-methylacetamide
CID 71970446

Frequently Asked Questions

What is the IUPAC name of 2-[5-[(E)-2-cyclohexyl-1-fluoroethenyl]-1,2,4-oxadiazol-3-yl]-N-cyclopentylacetamide?
The IUPAC name of 2-[5-[(E)-2-cyclohexyl-1-fluoroethenyl]-1,2,4-oxadiazol-3-yl]-N-cyclopentylacetamide (CID 138041785) is 2-[5-[(E)-2-cyclohexyl-1-fluoroethenyl]-1,2,4-oxadiazol-3-yl]-N-cyclopentylacetamide.
What is the SMILES notation for 2-[5-[(E)-2-cyclohexyl-1-fluoroethenyl]-1,2,4-oxadiazol-3-yl]-N-cyclopentylacetamide?
The canonical SMILES for 2-[5-[(E)-2-cyclohexyl-1-fluoroethenyl]-1,2,4-oxadiazol-3-yl]-N-cyclopentylacetamide is O=C(Cc1noc(/C(F)=C\C2CCCCC2)n1)NC1CCCC1.
What is the InChIKey of 2-[5-[(E)-2-cyclohexyl-1-fluoroethenyl]-1,2,4-oxadiazol-3-yl]-N-cyclopentylacetamide?
The InChIKey is UDCPOLFACKCGRN-GXDHUFHOSA-N. The full InChI is InChI=1S/C17H24FN3O2/c18-14(10-12-6-2-1-3-7-12)17-20-15(21-23-17)11-16(22)19-13-8-4-5-9-13/h10,12-13H,1-9,11H2,(H,19,22)/b14-10+.
What are the key properties of 2-[5-[(E)-2-cyclohexyl-1-fluoroethenyl]-1,2,4-oxadiazol-3-yl]-N-cyclopentylacetamide?
2-[5-[(E)-2-cyclohexyl-1-fluoroethenyl]-1,2,4-oxadiazol-3-yl]-N-cyclopentylacetamide has a molecular weight of 321.40 g/mol, XLogP of 3.56, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-[(E)-2-cyclohexyl-1-fluoroethenyl]-1,2,4-oxadiazol-3-yl]-N-cyclopentylacetamide is sourced from PubChem (CID 138041785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).