1-[5-(1,3-thiazol-4-yl)-1,2,4-oxadiazol-3-yl]propan-1-amine

C8H10N4OS — CID 63022879

IUPAC1-[5-(1,3-thiazol-4-yl)-1,2,4-oxadiazol-3-yl]propan-1-amine
SMILESCCC(N)c1noc(-c2cscn2)n1
InChIInChI=1S/C8H10N4OS/c1-2-5(9)7-11-8(13-12-7)6-3-14-4-10-6/h3-5H,2,9H2,1H3
InChIKeyGARMOANOUGQXSC-UHFFFAOYSA-N
MW210.26 g/mol
LogP1.60
Rot. Bonds3

About 1-[5-(1,3-thiazol-4-yl)-1,2,4-oxadiazol-3-yl]propan-1-amine

1-[5-(1,3-thiazol-4-yl)-1,2,4-oxadiazol-3-yl]propan-1-amine (PubChem CID 63022879) has the molecular formula C8H10N4OS and a molecular weight of 210.26 g/mol. Its IUPAC name is 1-[5-(1,3-thiazol-4-yl)-1,2,4-oxadiazol-3-yl]propan-1-amine.

Molecular Properties

Compound Name1-[5-(1,3-thiazol-4-yl)-1,2,4-oxadiazol-3-yl]propan-1-amine
PubChem CID63022879
Molecular FormulaC8H10N4OS
Molecular Weight210.26 g/mol
Exact Mass210.06
IUPAC Name1-[5-(1,3-thiazol-4-yl)-1,2,4-oxadiazol-3-yl]propan-1-amine
SMILESCCC(N)c1noc(-c2cscn2)n1
InChIInChI=1S/C8H10N4OS/c1-2-5(9)7-11-8(13-12-7)6-3-14-4-10-6/h3-5H,2,9H2,1H3
InChIKeyGARMOANOUGQXSC-UHFFFAOYSA-N
XLogP1.60
TPSA77.83 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.26
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 1-[5-(1,3-thiazol-4-yl)-1,2,4-oxadiazol-3-yl]propan-1-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

N-[[5-[2-[(N'-butylcarbamimidoyl)amino]-1,3-thiazol-4-yl]-1,2,4-oxadiazol-3-yl]methyl]acetamide
CID 11067703
2-(ethylamino)-N-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-N-methyl-1,3-thiazole-4-carboxamide
CID 71914809
3-(Oxolan-3-yl)-5-(1,3-thiazol-4-yl)-1,2,4-oxadiazole
CID 71971376
N-[4-(3-methyl-1,2,4-oxadiazol-5-yl)-1,3-thiazol-2-yl]acetamide
CID 155548149
4-(3-methyl-1,2,4-oxadiazol-5-yl)-N-propan-2-yl-1,3-thiazole-2-carboxamide
CID 53167422
4-(3-methyl-1,2,4-oxadiazol-5-yl)-N-(3-piperidin-1-ylpropyl)-1,3-thiazole-2-carboxamide
CID 53167424
N-cyclopropyl-4-(3-methyl-1,2,4-oxadiazol-5-yl)-1,3-thiazole-2-carboxamide
CID 53167426
N-Cycloheptyl-4-(3-ethyl-1,2,4-oxadiazol-5-YL)-1,3-thiazole-2-carboxamide
CID 53167529
3-(2-Methoxyethyl)-5-(2-propyl-1,3-thiazol-4-YL)-1,2,4-oxadiazole
CID 72849759
tert-butyl N-methyl-N-[(2S)-1-[5-(2-methyl-1,3-thiazol-4-yl)-1,2,4-oxadiazol-3-yl]propan-2-yl]carbamate
CID 97605081
N-[(1S)-1-(1,2,4-oxadiazol-3-yl)ethyl]-2-propan-2-yl-1,3-thiazole-4-carboxamide
CID 97802724
5-[1-(2,5-Dimethylpyrrolidin-1-yl)ethyl]-3-(1,3-thiazol-4-yl)-1,2,4-oxadiazole
CID 132384125

Frequently Asked Questions

What is the IUPAC name of 1-[5-(1,3-thiazol-4-yl)-1,2,4-oxadiazol-3-yl]propan-1-amine?
The IUPAC name of 1-[5-(1,3-thiazol-4-yl)-1,2,4-oxadiazol-3-yl]propan-1-amine (CID 63022879) is 1-[5-(1,3-thiazol-4-yl)-1,2,4-oxadiazol-3-yl]propan-1-amine.
What is the SMILES notation for 1-[5-(1,3-thiazol-4-yl)-1,2,4-oxadiazol-3-yl]propan-1-amine?
The canonical SMILES for 1-[5-(1,3-thiazol-4-yl)-1,2,4-oxadiazol-3-yl]propan-1-amine is CCC(N)c1noc(-c2cscn2)n1.
What is the InChIKey of 1-[5-(1,3-thiazol-4-yl)-1,2,4-oxadiazol-3-yl]propan-1-amine?
The InChIKey is GARMOANOUGQXSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4OS/c1-2-5(9)7-11-8(13-12-7)6-3-14-4-10-6/h3-5H,2,9H2,1H3.
What are the key properties of 1-[5-(1,3-thiazol-4-yl)-1,2,4-oxadiazol-3-yl]propan-1-amine?
1-[5-(1,3-thiazol-4-yl)-1,2,4-oxadiazol-3-yl]propan-1-amine has a molecular weight of 210.26 g/mol, XLogP of 1.60, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(1,3-thiazol-4-yl)-1,2,4-oxadiazol-3-yl]propan-1-amine is sourced from PubChem (CID 63022879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).