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

C17H13Cl2N3O2 — CID 27211747

IUPACN-(2,3-dichlorophenyl)-2-[5-(3-methylphenyl)-1,2,4-oxadiazol-3-yl]acetamide
SMILESCc1cccc(-c2nc(CC(=O)Nc3cccc(Cl)c3Cl)no2)c1
InChIInChI=1S/C17H13Cl2N3O2/c1-10-4-2-5-11(8-10)17-21-14(22-24-17)9-15(23)20-13-7-3-6-12(18)16(13)19/h2-8H,9H2,1H3,(H,20,23)
InChIKeyRWOJRSZHGYJYEF-UHFFFAOYSA-N
MW362.22 g/mol
LogP4.53
Rot. Bonds4

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

N-(2,3-dichlorophenyl)-2-[5-(3-methylphenyl)-1,2,4-oxadiazol-3-yl]acetamide (PubChem CID 27211747) has the molecular formula C17H13Cl2N3O2 and a molecular weight of 362.22 g/mol. Its IUPAC name is N-(2,3-dichlorophenyl)-2-[5-(3-methylphenyl)-1,2,4-oxadiazol-3-yl]acetamide.

Molecular Properties

Compound NameN-(2,3-dichlorophenyl)-2-[5-(3-methylphenyl)-1,2,4-oxadiazol-3-yl]acetamide
PubChem CID27211747
Molecular FormulaC17H13Cl2N3O2
Molecular Weight362.22 g/mol
Exact Mass361.04
IUPAC NameN-(2,3-dichlorophenyl)-2-[5-(3-methylphenyl)-1,2,4-oxadiazol-3-yl]acetamide
SMILESCc1cccc(-c2nc(CC(=O)Nc3cccc(Cl)c3Cl)no2)c1
InChIInChI=1S/C17H13Cl2N3O2/c1-10-4-2-5-11(8-10)17-21-14(22-24-17)9-15(23)20-13-7-3-6-12(18)16(13)19/h2-8H,9H2,1H3,(H,20,23)
InChIKeyRWOJRSZHGYJYEF-UHFFFAOYSA-N
XLogP4.53
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.22
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2,3-dichlorophenyl)-2-[5-(3-methylphenyl)-1,2,4-oxadiazol-3-yl]acetamide?
The IUPAC name of N-(2,3-dichlorophenyl)-2-[5-(3-methylphenyl)-1,2,4-oxadiazol-3-yl]acetamide (CID 27211747) is N-(2,3-dichlorophenyl)-2-[5-(3-methylphenyl)-1,2,4-oxadiazol-3-yl]acetamide.
What is the SMILES notation for N-(2,3-dichlorophenyl)-2-[5-(3-methylphenyl)-1,2,4-oxadiazol-3-yl]acetamide?
The canonical SMILES for N-(2,3-dichlorophenyl)-2-[5-(3-methylphenyl)-1,2,4-oxadiazol-3-yl]acetamide is Cc1cccc(-c2nc(CC(=O)Nc3cccc(Cl)c3Cl)no2)c1.
What is the InChIKey of N-(2,3-dichlorophenyl)-2-[5-(3-methylphenyl)-1,2,4-oxadiazol-3-yl]acetamide?
The InChIKey is RWOJRSZHGYJYEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13Cl2N3O2/c1-10-4-2-5-11(8-10)17-21-14(22-24-17)9-15(23)20-13-7-3-6-12(18)16(13)19/h2-8H,9H2,1H3,(H,20,23).
What are the key properties of N-(2,3-dichlorophenyl)-2-[5-(3-methylphenyl)-1,2,4-oxadiazol-3-yl]acetamide?
N-(2,3-dichlorophenyl)-2-[5-(3-methylphenyl)-1,2,4-oxadiazol-3-yl]acetamide has a molecular weight of 362.22 g/mol, XLogP of 4.53, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dichlorophenyl)-2-[5-(3-methylphenyl)-1,2,4-oxadiazol-3-yl]acetamide is sourced from PubChem (CID 27211747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).