N-benzyl-2-(5-naphthalen-1-yl-1,2,4-oxadiazol-3-yl)acetamide

C21H17N3O2 — CID 75494074

IUPACN-benzyl-2-(5-naphthalen-1-yl-1,2,4-oxadiazol-3-yl)acetamide
SMILESO=C(Cc1noc(-c2cccc3ccccc23)n1)NCc1ccccc1
InChIInChI=1S/C21H17N3O2/c25-20(22-14-15-7-2-1-3-8-15)13-19-23-21(26-24-19)18-12-6-10-16-9-4-5-11-17(16)18/h1-12H,13-14H2,(H,22,25)
InChIKeyBDVUSXSVIPQXTH-UHFFFAOYSA-N
MW343.39 g/mol
LogP3.75
Rot. Bonds5

About N-benzyl-2-(5-naphthalen-1-yl-1,2,4-oxadiazol-3-yl)acetamide

N-benzyl-2-(5-naphthalen-1-yl-1,2,4-oxadiazol-3-yl)acetamide (PubChem CID 75494074) has the molecular formula C21H17N3O2 and a molecular weight of 343.39 g/mol. Its IUPAC name is N-benzyl-2-(5-naphthalen-1-yl-1,2,4-oxadiazol-3-yl)acetamide.

Molecular Properties

Compound NameN-benzyl-2-(5-naphthalen-1-yl-1,2,4-oxadiazol-3-yl)acetamide
PubChem CID75494074
Molecular FormulaC21H17N3O2
Molecular Weight343.39 g/mol
Exact Mass343.13
IUPAC NameN-benzyl-2-(5-naphthalen-1-yl-1,2,4-oxadiazol-3-yl)acetamide
SMILESO=C(Cc1noc(-c2cccc3ccccc23)n1)NCc1ccccc1
InChIInChI=1S/C21H17N3O2/c25-20(22-14-15-7-2-1-3-8-15)13-19-23-21(26-24-19)18-12-6-10-16-9-4-5-11-17(16)18/h1-12H,13-14H2,(H,22,25)
InChIKeyBDVUSXSVIPQXTH-UHFFFAOYSA-N
XLogP3.75
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.39
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-benzyl-2-(5-naphthalen-1-yl-1,2,4-oxadiazol-3-yl)acetamide 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

N-benzyl-2-[5-(5-cyclopropyl-1,2-oxazol-3-yl)-1,2,4-oxadiazol-3-yl]acetamide
CID 71876926
(5-naphthalen-1-yl-1,2,4-oxadiazol-3-yl)methanamine
CID 61324776
N-[[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl]-2-phenylacetamide
CID 53098206
3-[2-(benzylamino)-2-oxoethyl]-N-(3-hydroxypropyl)-1,2,4-oxadiazole-5-carboxamide
CID 45491121
N-[[5-(3-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl]-2-phenylacetamide
CID 50755617
N-benzyl-2-[5-(1-phenylcyclobutyl)-1,2,4-oxadiazol-3-yl]acetamide
CID 71980384
2-[5-(2-methylphenyl)-1,2,4-oxadiazol-3-yl]-N-phenylacetamide
CID 27211449
N-benzyl-2-[5-[(1-hydroxycyclohexyl)methyl]-1,2,4-oxadiazol-3-yl]acetamide
CID 75506736
1-[4-[(5-naphthalen-1-yl-1,2,4-oxadiazol-3-yl)methyl]piperazin-1-yl]-3-phenylpropan-1-one
CID 42692012
N-benzyl-2-[[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]methylsulfanyl]acetamide
CID 46367622
2-chloro-N-[[5-(2-methylphenyl)-1,2,4-oxadiazol-3-yl]methyl]acetamide
CID 146094614
2-(5-methyl-1,2,4-oxadiazol-3-yl)-N-(pyridin-3-ylmethyl)acetamide
CID 90978973

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-(5-naphthalen-1-yl-1,2,4-oxadiazol-3-yl)acetamide?
The IUPAC name of N-benzyl-2-(5-naphthalen-1-yl-1,2,4-oxadiazol-3-yl)acetamide (CID 75494074) is N-benzyl-2-(5-naphthalen-1-yl-1,2,4-oxadiazol-3-yl)acetamide.
What is the SMILES notation for N-benzyl-2-(5-naphthalen-1-yl-1,2,4-oxadiazol-3-yl)acetamide?
The canonical SMILES for N-benzyl-2-(5-naphthalen-1-yl-1,2,4-oxadiazol-3-yl)acetamide is O=C(Cc1noc(-c2cccc3ccccc23)n1)NCc1ccccc1.
What is the InChIKey of N-benzyl-2-(5-naphthalen-1-yl-1,2,4-oxadiazol-3-yl)acetamide?
The InChIKey is BDVUSXSVIPQXTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17N3O2/c25-20(22-14-15-7-2-1-3-8-15)13-19-23-21(26-24-19)18-12-6-10-16-9-4-5-11-17(16)18/h1-12H,13-14H2,(H,22,25).
What are the key properties of N-benzyl-2-(5-naphthalen-1-yl-1,2,4-oxadiazol-3-yl)acetamide?
N-benzyl-2-(5-naphthalen-1-yl-1,2,4-oxadiazol-3-yl)acetamide has a molecular weight of 343.39 g/mol, XLogP of 3.75, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-(5-naphthalen-1-yl-1,2,4-oxadiazol-3-yl)acetamide is sourced from PubChem (CID 75494074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).