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

C14H17N3O2 — CID 91773590

IUPACN-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-3-phenylpropanamide
SMILESCCc1nnc(CNC(=O)CCc2ccccc2)o1
InChIInChI=1S/C14H17N3O2/c1-2-13-16-17-14(19-13)10-15-12(18)9-8-11-6-4-3-5-7-11/h3-7H,2,8-10H2,1H3,(H,15,18)
InChIKeyQNBBZNSLGSFGHK-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.88
Rot. Bonds6

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

N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-3-phenylpropanamide (PubChem CID 91773590) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-3-phenylpropanamide.

Molecular Properties

Compound NameN-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-3-phenylpropanamide
PubChem CID91773590
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC NameN-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-3-phenylpropanamide
SMILESCCc1nnc(CNC(=O)CCc2ccccc2)o1
InChIInChI=1S/C14H17N3O2/c1-2-13-16-17-14(19-13)10-15-12(18)9-8-11-6-4-3-5-7-11/h3-7H,2,8-10H2,1H3,(H,15,18)
InChIKeyQNBBZNSLGSFGHK-UHFFFAOYSA-N
XLogP1.88
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-3-phenylpropanamide 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-[[5-(2-methoxyphenyl)-1,3,4-oxadiazol-2-yl]methyl]-3-phenylpropanamide
CID 110319915
N-[[5-(5-methylpyrazin-2-yl)-1,3,4-oxadiazol-2-yl]methyl]-3-phenylpropanamide
CID 46956968
N-[2-(3-phenylpropanoylamino)ethyl]butanamide
CID 108573772
4-(4-methylphenyl)-N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]butanamide
CID 110615805
2-benzyl-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-1,3-thiazole-4-carboxamide
CID 70739356
3-(3-methoxyphenyl)-N-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)methyl]propanamide
CID 110368336
3-(3-methoxyphenyl)-N-[[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl]methyl]propanamide
CID 110408609
5-[[3-(4-ethylphenyl)propanoylamino]methyl]furan-2-carboxylic acid
CID 119246024
N-[(6-methyl-3-pyridinyl)methyl]-3-phenylpropanamide
CID 47038622
N-[(1-ethylpyrazol-3-yl)methyl]-3-phenylpropanamide
CID 19330999
3-[5-(2-phenylethyl)-1,3,4-oxadiazol-2-yl]-N-(quinolin-6-ylmethyl)propanamide
CID 42291978
N-[[4-(bromomethyl)phenyl]methyl]-3-phenylpropanamide
CID 107233854

Frequently Asked Questions

What is the IUPAC name of N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-3-phenylpropanamide?
The IUPAC name of N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-3-phenylpropanamide (CID 91773590) is N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-3-phenylpropanamide.
What is the SMILES notation for N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-3-phenylpropanamide?
The canonical SMILES for N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-3-phenylpropanamide is CCc1nnc(CNC(=O)CCc2ccccc2)o1.
What is the InChIKey of N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-3-phenylpropanamide?
The InChIKey is QNBBZNSLGSFGHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-2-13-16-17-14(19-13)10-15-12(18)9-8-11-6-4-3-5-7-11/h3-7H,2,8-10H2,1H3,(H,15,18).
What are the key properties of N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-3-phenylpropanamide?
N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-3-phenylpropanamide has a molecular weight of 259.31 g/mol, XLogP of 1.88, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-3-phenylpropanamide is sourced from PubChem (CID 91773590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).