N-cyclopropyl-2-(4-fluorophenyl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide

C19H16FN3O3 — CID 16589195

IUPACN-cyclopropyl-2-(4-fluorophenyl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide
SMILESO=C(NC1CC1)C(Oc1ccc(-c2nnco2)cc1)c1ccc(F)cc1
InChIInChI=1S/C19H16FN3O3/c20-14-5-1-12(2-6-14)17(18(24)22-15-7-8-15)26-16-9-3-13(4-10-16)19-23-21-11-25-19/h1-6,9-11,15,17H,7-8H2,(H,22,24)
InChIKeyXBIGNLRYYWRATA-UHFFFAOYSA-N
MW353.35 g/mol
LogP3.27
Rot. Bonds6

About N-cyclopropyl-2-(4-fluorophenyl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide

N-cyclopropyl-2-(4-fluorophenyl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide (PubChem CID 16589195) has the molecular formula C19H16FN3O3 and a molecular weight of 353.35 g/mol. Its IUPAC name is N-cyclopropyl-2-(4-fluorophenyl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-(4-fluorophenyl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide
PubChem CID16589195
Molecular FormulaC19H16FN3O3
Molecular Weight353.35 g/mol
Exact Mass353.12
IUPAC NameN-cyclopropyl-2-(4-fluorophenyl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide
SMILESO=C(NC1CC1)C(Oc1ccc(-c2nnco2)cc1)c1ccc(F)cc1
InChIInChI=1S/C19H16FN3O3/c20-14-5-1-12(2-6-14)17(18(24)22-15-7-8-15)26-16-9-3-13(4-10-16)19-23-21-11-25-19/h1-6,9-11,15,17H,7-8H2,(H,22,24)
InChIKeyXBIGNLRYYWRATA-UHFFFAOYSA-N
XLogP3.27
TPSA77.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.35
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-N-cyclopropyl-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]propanamide
CID 8528191
(2R)-2-(4-cyanophenoxy)-N-cyclopropyl-2-(4-fluorophenyl)acetamide
CID 42488371
(2S)-N-[(1S)-1-(4-fluorophenyl)ethyl]-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]propanamide
CID 8528203
(2S)-N-cyclohexyl-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]propanamide
CID 40693368
N-cyclohexyl-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]propanamide
CID 17409257
(2R)-1-(4-fluorophenoxy)-3-[4-(1,3,4-oxadiazol-2-yl)phenoxy]propan-2-ol
CID 97243398
(2R)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]propanamide
CID 7908205
[(1R)-2-(cyclopropylamino)-2-oxo-1-phenylethyl] (2S)-2-(4-fluorophenoxy)propanoate
CID 8637077
(2R)-1-[4-(difluoromethoxy)phenyl]-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]propan-1-one
CID 8528155
(2R)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]-N-(2,3,4-trifluorophenyl)propanamide
CID 7556105
N-[1-(4-fluorophenyl)ethyl]-4-(1,3,4-oxadiazol-2-yl)aniline
CID 43206403
[2-(cyclopropylamino)-1-(4-fluorophenyl)-2-oxoethyl] cyclobutanecarboxylate
CID 16588764

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-(4-fluorophenyl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide?
The IUPAC name of N-cyclopropyl-2-(4-fluorophenyl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide (CID 16589195) is N-cyclopropyl-2-(4-fluorophenyl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide.
What is the SMILES notation for N-cyclopropyl-2-(4-fluorophenyl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide?
The canonical SMILES for N-cyclopropyl-2-(4-fluorophenyl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide is O=C(NC1CC1)C(Oc1ccc(-c2nnco2)cc1)c1ccc(F)cc1.
What is the InChIKey of N-cyclopropyl-2-(4-fluorophenyl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide?
The InChIKey is XBIGNLRYYWRATA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16FN3O3/c20-14-5-1-12(2-6-14)17(18(24)22-15-7-8-15)26-16-9-3-13(4-10-16)19-23-21-11-25-19/h1-6,9-11,15,17H,7-8H2,(H,22,24).
What are the key properties of N-cyclopropyl-2-(4-fluorophenyl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide?
N-cyclopropyl-2-(4-fluorophenyl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide has a molecular weight of 353.35 g/mol, XLogP of 3.27, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(4-fluorophenyl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide is sourced from PubChem (CID 16589195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).