1-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propan-2-amine

C9H11N3OS — CID 43358218

IUPAC1-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propan-2-amine
SMILESCC(N)Cc1nc(-c2cccs2)no1
InChIInChI=1S/C9H11N3OS/c1-6(10)5-8-11-9(12-13-8)7-3-2-4-14-7/h2-4,6H,5,10H2,1H3
InChIKeyWGAWWZNGFBFRKN-UHFFFAOYSA-N
MW209.27 g/mol
LogP1.69
Rot. Bonds3

About 1-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propan-2-amine

1-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propan-2-amine (PubChem CID 43358218) has the molecular formula C9H11N3OS and a molecular weight of 209.27 g/mol. Its IUPAC name is 1-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propan-2-amine.

Molecular Properties

Compound Name1-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propan-2-amine
PubChem CID43358218
Molecular FormulaC9H11N3OS
Molecular Weight209.27 g/mol
Exact Mass209.06
IUPAC Name1-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propan-2-amine
SMILESCC(N)Cc1nc(-c2cccs2)no1
InChIInChI=1S/C9H11N3OS/c1-6(10)5-8-11-9(12-13-8)7-3-2-4-14-7/h2-4,6H,5,10H2,1H3
InChIKeyWGAWWZNGFBFRKN-UHFFFAOYSA-N
XLogP1.69
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.27
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propan-2-amine 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

(1S)-1-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)ethanamine
CID 40800258
(2R)-N-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]butan-2-amine
CID 27261231
1-phenyl-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propan-1-amine
CID 60837559
1-cyclopropyl-N-ethyl-2-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)ethanamine
CID 63347362
N-(3-aminobutyl)-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanamide;hydrochloride
CID 119495002
5-(2-piperidin-3-ylpropyl)-3-thiophen-2-yl-1,2,4-oxadiazole
CID 81046211
(2R)-2-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methoxy]propanoic acid
CID 104875022
N-ethyl-4-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)butan-2-amine
CID 63347277
2-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methylsulfonyl]propanamide
CID 47206964
1,1-difluoro-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propan-2-one
CID 63346751
(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl 2-(thiophene-2-carbonylamino)propanoate
CID 55484421
1-(3-thieno[3,2-b]pyridin-6-yl-1,2,4-oxadiazol-5-yl)propan-2-amine
CID 81147332

Frequently Asked Questions

What is the IUPAC name of 1-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propan-2-amine?
The IUPAC name of 1-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propan-2-amine (CID 43358218) is 1-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propan-2-amine.
What is the SMILES notation for 1-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propan-2-amine?
The canonical SMILES for 1-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propan-2-amine is CC(N)Cc1nc(-c2cccs2)no1.
What is the InChIKey of 1-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propan-2-amine?
The InChIKey is WGAWWZNGFBFRKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3OS/c1-6(10)5-8-11-9(12-13-8)7-3-2-4-14-7/h2-4,6H,5,10H2,1H3.
What are the key properties of 1-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propan-2-amine?
1-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propan-2-amine has a molecular weight of 209.27 g/mol, XLogP of 1.69, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propan-2-amine is sourced from PubChem (CID 43358218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).