N-(2-methoxyphenyl)-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanamide

C16H15N3O3S — CID 3240224

IUPACN-(2-methoxyphenyl)-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanamide
SMILESCOc1ccccc1NC(=O)CCc1nc(-c2cccs2)no1
InChIInChI=1S/C16H15N3O3S/c1-21-12-6-3-2-5-11(12)17-14(20)8-9-15-18-16(19-22-15)13-7-4-10-23-13/h2-7,10H,8-9H2,1H3,(H,17,20)
InChIKeyCVPUYQDPWZTWMF-UHFFFAOYSA-N
MW329.38 g/mol
LogP3.38
Rot. Bonds6

About N-(2-methoxyphenyl)-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanamide

N-(2-methoxyphenyl)-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanamide (PubChem CID 3240224) has the molecular formula C16H15N3O3S and a molecular weight of 329.38 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanamide.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanamide
PubChem CID3240224
Molecular FormulaC16H15N3O3S
Molecular Weight329.38 g/mol
Exact Mass329.08
IUPAC NameN-(2-methoxyphenyl)-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanamide
SMILESCOc1ccccc1NC(=O)CCc1nc(-c2cccs2)no1
InChIInChI=1S/C16H15N3O3S/c1-21-12-6-3-2-5-11(12)17-14(20)8-9-15-18-16(19-22-15)13-7-4-10-23-13/h2-7,10H,8-9H2,1H3,(H,17,20)
InChIKeyCVPUYQDPWZTWMF-UHFFFAOYSA-N
XLogP3.38
TPSA77.25 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.38
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-(2-methoxyphenyl)-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanamide?
The IUPAC name of N-(2-methoxyphenyl)-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanamide (CID 3240224) is N-(2-methoxyphenyl)-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanamide.
What is the SMILES notation for N-(2-methoxyphenyl)-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanamide?
The canonical SMILES for N-(2-methoxyphenyl)-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanamide is COc1ccccc1NC(=O)CCc1nc(-c2cccs2)no1.
What is the InChIKey of N-(2-methoxyphenyl)-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanamide?
The InChIKey is CVPUYQDPWZTWMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O3S/c1-21-12-6-3-2-5-11(12)17-14(20)8-9-15-18-16(19-22-15)13-7-4-10-23-13/h2-7,10H,8-9H2,1H3,(H,17,20).
What are the key properties of N-(2-methoxyphenyl)-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanamide?
N-(2-methoxyphenyl)-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanamide has a molecular weight of 329.38 g/mol, XLogP of 3.38, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanamide is sourced from PubChem (CID 3240224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).