N-[2-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)thiophen-3-yl]-2-(4-fluorophenoxy)acetamide

C17H14FN3O3S — CID 53163597

IUPACN-[2-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)thiophen-3-yl]-2-(4-fluorophenoxy)acetamide
SMILESO=C(COc1ccc(F)cc1)Nc1ccsc1-c1nnc(C2CC2)o1
InChIInChI=1S/C17H14FN3O3S/c18-11-3-5-12(6-4-11)23-9-14(22)19-13-7-8-25-15(13)17-21-20-16(24-17)10-1-2-10/h3-8,10H,1-2,9H2,(H,19,22)
InChIKeyJYZKUUKFSKZBBF-UHFFFAOYSA-N
MW359.38 g/mol
LogP3.83
Rot. Bonds6

About N-[2-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)thiophen-3-yl]-2-(4-fluorophenoxy)acetamide

N-[2-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)thiophen-3-yl]-2-(4-fluorophenoxy)acetamide (PubChem CID 53163597) has the molecular formula C17H14FN3O3S and a molecular weight of 359.38 g/mol. Its IUPAC name is N-[2-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)thiophen-3-yl]-2-(4-fluorophenoxy)acetamide.

Molecular Properties

Compound NameN-[2-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)thiophen-3-yl]-2-(4-fluorophenoxy)acetamide
PubChem CID53163597
Molecular FormulaC17H14FN3O3S
Molecular Weight359.38 g/mol
Exact Mass359.07
IUPAC NameN-[2-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)thiophen-3-yl]-2-(4-fluorophenoxy)acetamide
SMILESO=C(COc1ccc(F)cc1)Nc1ccsc1-c1nnc(C2CC2)o1
InChIInChI=1S/C17H14FN3O3S/c18-11-3-5-12(6-4-11)23-9-14(22)19-13-7-8-25-15(13)17-21-20-16(24-17)10-1-2-10/h3-8,10H,1-2,9H2,(H,19,22)
InChIKeyJYZKUUKFSKZBBF-UHFFFAOYSA-N
XLogP3.83
TPSA77.25 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.38
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[2-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)thiophen-3-yl]-2-methoxybenzamide
CID 53163569
N-[2-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)thiophen-3-yl]-2,4-dimethylbenzamide
CID 53163565
N-[2-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)thiophen-3-yl]-1H-indole-2-carboxamide
CID 53163593
2-(4-chlorophenoxy)-N-[[4-[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]cyclohexyl]methyl]acetamide
CID 165399699
2-(2,4-difluorophenoxy)-N-[[4-[5-(4-methyl-1,3-thiazol-5-yl)-1,3,4-oxadiazol-2-yl]cyclohexyl]methyl]acetamide
CID 98065544
N-(3-cyanothiophen-2-yl)-2-(4-fluorophenoxy)acetamide
CID 9415681
N-[5-[(3S)-1-(4-ethoxyphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-oxadiazol-2-yl]-2-(4-fluorophenoxy)acetamide
CID 92898150
2-(4-fluorophenoxy)-N-[5-(5-oxo-1-phenylpyrrolidin-3-yl)-1,3,4-oxadiazol-2-yl]acetamide
CID 50837467
2-(4-methoxyphenoxy)-N-[[4-[5-(6-methyl-3-pyridinyl)-1,3,4-oxadiazol-2-yl]cyclohexyl]methyl]acetamide
CID 98065252
(4-ethoxyphenyl)-[3-[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]methanone
CID 121069342
3-[[2-(4-fluorophenoxy)acetyl]amino]pyridine-2-carboxylic acid
CID 104739937
2-(4-fluorophenoxy)-N-[3-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]acetamide
CID 17359046

Frequently Asked Questions

What is the IUPAC name of N-[2-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)thiophen-3-yl]-2-(4-fluorophenoxy)acetamide?
The IUPAC name of N-[2-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)thiophen-3-yl]-2-(4-fluorophenoxy)acetamide (CID 53163597) is N-[2-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)thiophen-3-yl]-2-(4-fluorophenoxy)acetamide.
What is the SMILES notation for N-[2-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)thiophen-3-yl]-2-(4-fluorophenoxy)acetamide?
The canonical SMILES for N-[2-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)thiophen-3-yl]-2-(4-fluorophenoxy)acetamide is O=C(COc1ccc(F)cc1)Nc1ccsc1-c1nnc(C2CC2)o1.
What is the InChIKey of N-[2-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)thiophen-3-yl]-2-(4-fluorophenoxy)acetamide?
The InChIKey is JYZKUUKFSKZBBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14FN3O3S/c18-11-3-5-12(6-4-11)23-9-14(22)19-13-7-8-25-15(13)17-21-20-16(24-17)10-1-2-10/h3-8,10H,1-2,9H2,(H,19,22).
What are the key properties of N-[2-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)thiophen-3-yl]-2-(4-fluorophenoxy)acetamide?
N-[2-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)thiophen-3-yl]-2-(4-fluorophenoxy)acetamide has a molecular weight of 359.38 g/mol, XLogP of 3.83, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)thiophen-3-yl]-2-(4-fluorophenoxy)acetamide is sourced from PubChem (CID 53163597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).