N-(2-chlorophenyl)-2-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)phenoxy]butanamide

C24H20ClN3O3 — CID 20943891

IUPACN-(2-chlorophenyl)-2-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)phenoxy]butanamide
SMILESCCC(Oc1ccccc1-c1nnc(-c2ccccc2)o1)C(=O)Nc1ccccc1Cl
InChIInChI=1S/C24H20ClN3O3/c1-2-20(22(29)26-19-14-8-7-13-18(19)25)30-21-15-9-6-12-17(21)24-28-27-23(31-24)16-10-4-3-5-11-16/h3-15,20H,2H2,1H3,(H,26,29)
InChIKeyFZIXJUJKAITZJO-UHFFFAOYSA-N
MW433.90 g/mol
LogP5.85
Rot. Bonds7

About N-(2-chlorophenyl)-2-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)phenoxy]butanamide

N-(2-chlorophenyl)-2-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)phenoxy]butanamide (PubChem CID 20943891) has the molecular formula C24H20ClN3O3 and a molecular weight of 433.90 g/mol. Its IUPAC name is N-(2-chlorophenyl)-2-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)phenoxy]butanamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-2-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)phenoxy]butanamide
PubChem CID20943891
Molecular FormulaC24H20ClN3O3
Molecular Weight433.90 g/mol
Exact Mass433.12
IUPAC NameN-(2-chlorophenyl)-2-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)phenoxy]butanamide
SMILESCCC(Oc1ccccc1-c1nnc(-c2ccccc2)o1)C(=O)Nc1ccccc1Cl
InChIInChI=1S/C24H20ClN3O3/c1-2-20(22(29)26-19-14-8-7-13-18(19)25)30-21-15-9-6-12-17(21)24-28-27-23(31-24)16-10-4-3-5-11-16/h3-15,20H,2H2,1H3,(H,26,29)
InChIKeyFZIXJUJKAITZJO-UHFFFAOYSA-N
XLogP5.85
TPSA77.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500433.90
LogP ≤ 55.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-methylphenyl)-2-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)phenoxy]propanamide
CID 20943882
(2R)-N-(2-chlorophenyl)-2-naphthalen-1-yloxybutanamide
CID 94019163
2-[2-(2-chlorophenoxy)butanoylamino]benzamide
CID 53284900
(2S)-N-(2,3-dichlorophenyl)-2-(2-methoxyphenoxy)butanamide
CID 9173593
2-(2-chlorophenoxy)-N-(2-propan-2-yloxyphenyl)butanamide
CID 53284308
N-(2-chlorophenyl)-2-(4-fluorophenoxy)butanamide
CID 46771035
N-(2-chlorophenyl)-2-(2,5-dimethylphenoxy)butanamide
CID 132760463
(2R)-2-(2-chlorophenoxy)-N-(2,4,5-trichlorophenyl)butanamide
CID 28573433
(2S)-2-(2-chlorophenoxy)-N-(2,4,5-trichlorophenyl)butanamide
CID 28573436
N-[(2-chlorophenyl)methyl]-2-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)phenoxy]acetamide
CID 20939886
(2R)-N-(2,3-dichlorophenyl)-2-naphthalen-1-yloxybutanamide
CID 28633203
2-(4-chloro-3-methylphenoxy)-N-(2-chlorophenyl)butanamide
CID 132651835

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-2-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)phenoxy]butanamide?
The IUPAC name of N-(2-chlorophenyl)-2-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)phenoxy]butanamide (CID 20943891) is N-(2-chlorophenyl)-2-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)phenoxy]butanamide.
What is the SMILES notation for N-(2-chlorophenyl)-2-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)phenoxy]butanamide?
The canonical SMILES for N-(2-chlorophenyl)-2-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)phenoxy]butanamide is CCC(Oc1ccccc1-c1nnc(-c2ccccc2)o1)C(=O)Nc1ccccc1Cl.
What is the InChIKey of N-(2-chlorophenyl)-2-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)phenoxy]butanamide?
The InChIKey is FZIXJUJKAITZJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20ClN3O3/c1-2-20(22(29)26-19-14-8-7-13-18(19)25)30-21-15-9-6-12-17(21)24-28-27-23(31-24)16-10-4-3-5-11-16/h3-15,20H,2H2,1H3,(H,26,29).
What are the key properties of N-(2-chlorophenyl)-2-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)phenoxy]butanamide?
N-(2-chlorophenyl)-2-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)phenoxy]butanamide has a molecular weight of 433.90 g/mol, XLogP of 5.85, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-2-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)phenoxy]butanamide is sourced from PubChem (CID 20943891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).