N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methyl-2-oxo-2-phenylacetamide

C14H15N3O3 — CID 91775014

IUPACN-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methyl-2-oxo-2-phenylacetamide
SMILESCCc1nnc(CN(C)C(=O)C(=O)c2ccccc2)o1
InChIInChI=1S/C14H15N3O3/c1-3-11-15-16-12(20-11)9-17(2)14(19)13(18)10-7-5-4-6-8-10/h4-8H,3,9H2,1-2H3
InChIKeyMFNYXDSNUWRJML-UHFFFAOYSA-N
MW273.29 g/mol
LogP1.47
Rot. Bonds5

About N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methyl-2-oxo-2-phenylacetamide

N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methyl-2-oxo-2-phenylacetamide (PubChem CID 91775014) has the molecular formula C14H15N3O3 and a molecular weight of 273.29 g/mol. Its IUPAC name is N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methyl-2-oxo-2-phenylacetamide.

Molecular Properties

Compound NameN-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methyl-2-oxo-2-phenylacetamide
PubChem CID91775014
Molecular FormulaC14H15N3O3
Molecular Weight273.29 g/mol
Exact Mass273.11
IUPAC NameN-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methyl-2-oxo-2-phenylacetamide
SMILESCCc1nnc(CN(C)C(=O)C(=O)c2ccccc2)o1
InChIInChI=1S/C14H15N3O3/c1-3-11-15-16-12(20-11)9-17(2)14(19)13(18)10-7-5-4-6-8-10/h4-8H,3,9H2,1-2H3
InChIKeyMFNYXDSNUWRJML-UHFFFAOYSA-N
XLogP1.47
TPSA76.30 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.29
LogP ≤ 51.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

N-[(5-Ethyl-1,3,4-oxadiazol-2-YL)methyl]-N-methyl-2-(2-oxo-4-phenylpyrrolidin-1-YL)acetamide
CID 72865994
N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-3-(3-hydroxy-3-methylbutyl)-N-methylbenzamide
CID 70712506
N-[(5-amino-1,3,4-oxadiazol-2-yl)methyl]-N-methylbenzamide
CID 28307252
2-[(5-isopropyl-1,3,4-oxadiazol-2-yl)methyl]phthalazin-1(2H)-one
CID 72857134
2-(3,5-Difluorophenyl)-N-[(5-methyl-1,3,4-oxadiazol-2-YL)methyl]acetamide
CID 77088905
N-({1-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-yl}methyl)benzamide
CID 131910308
[4-[(5-Ethyl-1,3,4-oxadiazol-2-yl)methyl]piperazin-1-yl]-(2-fluorophenyl)methanone
CID 24674509
[4-[(5-Ethyl-1,3,4-oxadiazol-2-yl)methyl]piperazin-1-yl]-(4-fluorophenyl)methanone
CID 36877918
2-(4-Fluorophenyl)-1-[4-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]piperazin-1-yl]ethanone
CID 38136380
[4-[(5-Ethyl-1,3,4-oxadiazol-2-yl)methyl]piperazin-1-yl]-(3-fluoro-4-methylphenyl)methanone
CID 52345423
[4-[(5-Tert-butyl-1,3,4-oxadiazol-2-yl)methyl]piperazin-1-yl]-(3-fluoro-4-methylphenyl)methanone
CID 52345426
(2,4-Difluorophenyl)-[4-[1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]methanone
CID 53565666

Frequently Asked Questions

What is the IUPAC name of N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methyl-2-oxo-2-phenylacetamide?
The IUPAC name of N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methyl-2-oxo-2-phenylacetamide (CID 91775014) is N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methyl-2-oxo-2-phenylacetamide.
What is the SMILES notation for N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methyl-2-oxo-2-phenylacetamide?
The canonical SMILES for N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methyl-2-oxo-2-phenylacetamide is CCc1nnc(CN(C)C(=O)C(=O)c2ccccc2)o1.
What is the InChIKey of N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methyl-2-oxo-2-phenylacetamide?
The InChIKey is MFNYXDSNUWRJML-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O3/c1-3-11-15-16-12(20-11)9-17(2)14(19)13(18)10-7-5-4-6-8-10/h4-8H,3,9H2,1-2H3.
What are the key properties of N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methyl-2-oxo-2-phenylacetamide?
N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methyl-2-oxo-2-phenylacetamide has a molecular weight of 273.29 g/mol, XLogP of 1.47, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-N-methyl-2-oxo-2-phenylacetamide is sourced from PubChem (CID 91775014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).