N-(3-chloro-4-methylphenyl)-4-(5-ethyl-1,2,4-oxadiazol-3-yl)benzamide

C18H16ClN3O2 — CID 50767274

IUPACN-(3-chloro-4-methylphenyl)-4-(5-ethyl-1,2,4-oxadiazol-3-yl)benzamide
SMILESCCc1nc(-c2ccc(C(=O)Nc3ccc(C)c(Cl)c3)cc2)no1
InChIInChI=1S/C18H16ClN3O2/c1-3-16-21-17(22-24-16)12-5-7-13(8-6-12)18(23)20-14-9-4-11(2)15(19)10-14/h4-10H,3H2,1-2H3,(H,20,23)
InChIKeyXGCCTYUQKJMPDD-UHFFFAOYSA-N
MW341.80 g/mol
LogP4.51
Rot. Bonds4

About N-(3-chloro-4-methylphenyl)-4-(5-ethyl-1,2,4-oxadiazol-3-yl)benzamide

N-(3-chloro-4-methylphenyl)-4-(5-ethyl-1,2,4-oxadiazol-3-yl)benzamide (PubChem CID 50767274) has the molecular formula C18H16ClN3O2 and a molecular weight of 341.80 g/mol. Its IUPAC name is N-(3-chloro-4-methylphenyl)-4-(5-ethyl-1,2,4-oxadiazol-3-yl)benzamide.

Molecular Properties

Compound NameN-(3-chloro-4-methylphenyl)-4-(5-ethyl-1,2,4-oxadiazol-3-yl)benzamide
PubChem CID50767274
Molecular FormulaC18H16ClN3O2
Molecular Weight341.80 g/mol
Exact Mass341.09
IUPAC NameN-(3-chloro-4-methylphenyl)-4-(5-ethyl-1,2,4-oxadiazol-3-yl)benzamide
SMILESCCc1nc(-c2ccc(C(=O)Nc3ccc(C)c(Cl)c3)cc2)no1
InChIInChI=1S/C18H16ClN3O2/c1-3-16-21-17(22-24-16)12-5-7-13(8-6-12)18(23)20-14-9-4-11(2)15(19)10-14/h4-10H,3H2,1-2H3,(H,20,23)
InChIKeyXGCCTYUQKJMPDD-UHFFFAOYSA-N
XLogP4.51
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.80
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(3-chloro-4-methylphenyl)-4-(5-ethyl-1,2,4-oxadiazol-3-yl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(5-ethyl-1,2,4-oxadiazol-3-yl)-N-[2-(3-fluoro-4-methylanilino)-2-oxoethyl]benzamide
CID 50780617
N-(3-chloro-4-methylphenyl)-5-(5-ethyl-1,2,4-oxadiazol-3-yl)-2-methylbenzenesulfonamide
CID 46365775
N-(3-chloro-4-methylphenyl)-4-methylbenzamide
CID 710602
N-[2-(3-chloroanilino)-2-oxoethyl]-4-(5-ethyl-1,2,4-oxadiazol-3-yl)benzamide
CID 50780349
N-(3-chloro-4-methylphenyl)-4-(propanoylamino)benzamide
CID 2984948
4-(5-ethyl-1,2,4-oxadiazol-3-yl)-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide
CID 50767260
N-(3-chloro-4-methylphenyl)-3-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]propanamide
CID 26688026
N-(3-chloro-4-methylphenyl)-4-(1,3,4-oxadiazol-2-yl)benzamide
CID 9072722
N-(3-chloro-4-methylphenyl)pyridine-4-carboxamide;hydrochloride
CID 110756427
1-N-butyl-4-N-(3-chloro-4-methylphenyl)benzene-1,4-dicarboxamide
CID 109043760
N-[2-(2,4-dimethylanilino)-2-oxoethyl]-4-(5-ethyl-1,2,4-oxadiazol-3-yl)benzamide
CID 50780544
N-(3-chloro-4-methylphenyl)-3-ethyl-5-methyl-1,2-oxazole-4-carboxamide
CID 9068463

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-methylphenyl)-4-(5-ethyl-1,2,4-oxadiazol-3-yl)benzamide?
The IUPAC name of N-(3-chloro-4-methylphenyl)-4-(5-ethyl-1,2,4-oxadiazol-3-yl)benzamide (CID 50767274) is N-(3-chloro-4-methylphenyl)-4-(5-ethyl-1,2,4-oxadiazol-3-yl)benzamide.
What is the SMILES notation for N-(3-chloro-4-methylphenyl)-4-(5-ethyl-1,2,4-oxadiazol-3-yl)benzamide?
The canonical SMILES for N-(3-chloro-4-methylphenyl)-4-(5-ethyl-1,2,4-oxadiazol-3-yl)benzamide is CCc1nc(-c2ccc(C(=O)Nc3ccc(C)c(Cl)c3)cc2)no1.
What is the InChIKey of N-(3-chloro-4-methylphenyl)-4-(5-ethyl-1,2,4-oxadiazol-3-yl)benzamide?
The InChIKey is XGCCTYUQKJMPDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16ClN3O2/c1-3-16-21-17(22-24-16)12-5-7-13(8-6-12)18(23)20-14-9-4-11(2)15(19)10-14/h4-10H,3H2,1-2H3,(H,20,23).
What are the key properties of N-(3-chloro-4-methylphenyl)-4-(5-ethyl-1,2,4-oxadiazol-3-yl)benzamide?
N-(3-chloro-4-methylphenyl)-4-(5-ethyl-1,2,4-oxadiazol-3-yl)benzamide has a molecular weight of 341.80 g/mol, XLogP of 4.51, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-methylphenyl)-4-(5-ethyl-1,2,4-oxadiazol-3-yl)benzamide is sourced from PubChem (CID 50767274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).