2-(4-chlorophenyl)-N-[4-(4-chlorophenyl)-1,2,5-oxadiazol-3-yl]acetamide

C16H11Cl2N3O2 — CID 17013049

IUPAC2-(4-chlorophenyl)-N-[4-(4-chlorophenyl)-1,2,5-oxadiazol-3-yl]acetamide
SMILESO=C(Cc1ccc(Cl)cc1)Nc1nonc1-c1ccc(Cl)cc1
InChIInChI=1S/C16H11Cl2N3O2/c17-12-5-1-10(2-6-12)9-14(22)19-16-15(20-23-21-16)11-3-7-13(18)8-4-11/h1-8H,9H2,(H,19,21,22)
InChIKeyFVJWVGMTAGGBSL-UHFFFAOYSA-N
MW348.19 g/mol
LogP4.22
Rot. Bonds4

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

2-(4-chlorophenyl)-N-[4-(4-chlorophenyl)-1,2,5-oxadiazol-3-yl]acetamide (PubChem CID 17013049) has the molecular formula C16H11Cl2N3O2 and a molecular weight of 348.19 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-N-[4-(4-chlorophenyl)-1,2,5-oxadiazol-3-yl]acetamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)-N-[4-(4-chlorophenyl)-1,2,5-oxadiazol-3-yl]acetamide
PubChem CID17013049
Molecular FormulaC16H11Cl2N3O2
Molecular Weight348.19 g/mol
Exact Mass347.02
IUPAC Name2-(4-chlorophenyl)-N-[4-(4-chlorophenyl)-1,2,5-oxadiazol-3-yl]acetamide
SMILESO=C(Cc1ccc(Cl)cc1)Nc1nonc1-c1ccc(Cl)cc1
InChIInChI=1S/C16H11Cl2N3O2/c17-12-5-1-10(2-6-12)9-14(22)19-16-15(20-23-21-16)11-3-7-13(18)8-4-11/h1-8H,9H2,(H,19,21,22)
InChIKeyFVJWVGMTAGGBSL-UHFFFAOYSA-N
XLogP4.22
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.19
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[4-(4-chlorophenyl)-1,2,5-oxadiazol-3-yl]-1-methyl-1-phenylurea
CID 90665261
N-[4-(4-chlorophenyl)-1,2,5-oxadiazol-3-yl]-2-propoxybenzamide
CID 7677392
2-(4-methoxyphenyl)-N-[4-[[2-(4-methoxyphenyl)acetyl]amino]-1,2,5-oxadiazol-3-yl]acetamide
CID 3596684
benzene;bis(2-(4-chlorophenoxy)-N-[4-(3,4-dimethoxyphenyl)-1,2,5-oxadiazol-3-yl]acetamide)
CID 175653131
N-[4-(4-fluorophenyl)-1,2,5-oxadiazol-3-yl]pentanamide
CID 7711361
3-methyl-N-(4-phenyl-1,2,5-oxadiazol-3-yl)butanamide
CID 7678267
2-(4-chlorophenyl)-N-[3-(4-hydroxyphenyl)-5-phenylpyrazin-2-yl]acetamide
CID 136624974
N',N'-diethyl-N-[4-(4-methylphenyl)-1,2,5-oxadiazol-3-yl]butanediamide
CID 71856770
N-(4-phenyl-1,2,5-oxadiazol-3-yl)-2-phenylsulfanylacetamide
CID 1108413
N-[4-[(E)-C-[(3-chloro-4-fluorophenyl)methyl]-N-hydroxycarbonimidoyl]-1,2,5-oxadiazol-3-yl]-2-(4-fluorophenyl)acetamide
CID 172962402
2-(3-chlorophenoxy)-N-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2,5-oxadiazol-3-yl]acetamide
CID 19244662
1,3-bis[4-(4-chlorophenyl)phenyl]propan-2-one
CID 141275371

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-N-[4-(4-chlorophenyl)-1,2,5-oxadiazol-3-yl]acetamide?
The IUPAC name of 2-(4-chlorophenyl)-N-[4-(4-chlorophenyl)-1,2,5-oxadiazol-3-yl]acetamide (CID 17013049) is 2-(4-chlorophenyl)-N-[4-(4-chlorophenyl)-1,2,5-oxadiazol-3-yl]acetamide.
What is the SMILES notation for 2-(4-chlorophenyl)-N-[4-(4-chlorophenyl)-1,2,5-oxadiazol-3-yl]acetamide?
The canonical SMILES for 2-(4-chlorophenyl)-N-[4-(4-chlorophenyl)-1,2,5-oxadiazol-3-yl]acetamide is O=C(Cc1ccc(Cl)cc1)Nc1nonc1-c1ccc(Cl)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-N-[4-(4-chlorophenyl)-1,2,5-oxadiazol-3-yl]acetamide?
The InChIKey is FVJWVGMTAGGBSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11Cl2N3O2/c17-12-5-1-10(2-6-12)9-14(22)19-16-15(20-23-21-16)11-3-7-13(18)8-4-11/h1-8H,9H2,(H,19,21,22).
What are the key properties of 2-(4-chlorophenyl)-N-[4-(4-chlorophenyl)-1,2,5-oxadiazol-3-yl]acetamide?
2-(4-chlorophenyl)-N-[4-(4-chlorophenyl)-1,2,5-oxadiazol-3-yl]acetamide has a molecular weight of 348.19 g/mol, XLogP of 4.22, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-N-[4-(4-chlorophenyl)-1,2,5-oxadiazol-3-yl]acetamide is sourced from PubChem (CID 17013049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).