5-(5-phenyl-1,3,4-oxadiazol-2-yl)-1,3-thiazol-2-amine

C11H8N4OS — CID 83301136

IUPAC5-(5-phenyl-1,3,4-oxadiazol-2-yl)-1,3-thiazol-2-amine
SMILESNc1ncc(-c2nnc(-c3ccccc3)o2)s1
InChIInChI=1S/C11H8N4OS/c12-11-13-6-8(17-11)10-15-14-9(16-10)7-4-2-1-3-5-7/h1-6H,(H2,12,13)
InChIKeyQYVJNGCQMMWYSX-UHFFFAOYSA-N
MW244.28 g/mol
LogP2.44
Rot. Bonds2

About 5-(5-phenyl-1,3,4-oxadiazol-2-yl)-1,3-thiazol-2-amine

5-(5-phenyl-1,3,4-oxadiazol-2-yl)-1,3-thiazol-2-amine (PubChem CID 83301136) has the molecular formula C11H8N4OS and a molecular weight of 244.28 g/mol. Its IUPAC name is 5-(5-phenyl-1,3,4-oxadiazol-2-yl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-(5-phenyl-1,3,4-oxadiazol-2-yl)-1,3-thiazol-2-amine
PubChem CID83301136
Molecular FormulaC11H8N4OS
Molecular Weight244.28 g/mol
Exact Mass244.04
IUPAC Name5-(5-phenyl-1,3,4-oxadiazol-2-yl)-1,3-thiazol-2-amine
SMILESNc1ncc(-c2nnc(-c3ccccc3)o2)s1
InChIInChI=1S/C11H8N4OS/c12-11-13-6-8(17-11)10-15-14-9(16-10)7-4-2-1-3-5-7/h1-6H,(H2,12,13)
InChIKeyQYVJNGCQMMWYSX-UHFFFAOYSA-N
XLogP2.44
TPSA77.83 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.28
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

ethane;5-phenyl-1,3-thiazol-2-amine
CID 142092018
ethane;2-phenyl-5-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-1,3,4-oxadiazole
CID 144770943
bis(2,2-dimethylpropane);2,5-diphenyl-1,3,4-oxadiazole
CID 160836587
2,5-bis[4-(2,3,4,5,6-pentakis-phenylphenyl)phenyl]-1,3,4-oxadiazole
CID 101440187
2-phenyl-5-[3,10,11-tris(5-phenyl-1,3,4-oxadiazol-2-yl)tetraphenylen-2-yl]-1,3,4-oxadiazole
CID 59855596
3-(2-amino-1,3-thiazol-5-yl)benzonitrile
CID 61025504
2-phenyl-5-(6-phenyl-2-pyridinyl)-1,3,4-oxadiazole
CID 59236801
2-phenyl-5-quinolin-3-yl-1,3,4-oxadiazole
CID 142733340
5-(3-phenylmethoxyphenyl)-1,3-thiazol-2-amine
CID 164893342
3-(5-phenyl-1,3,4-oxadiazol-2-yl)-5-(2-phenylphenyl)pyrazin-2-amine
CID 59471915
2-(3-methyl-1-phenylthieno[3,2-d]pyrazol-5-yl)-5-phenyl-1,3,4-oxadiazole
CID 139217553
5-(4-phenylmethoxyphenyl)-1,3-thiazol-2-amine
CID 116811767

Frequently Asked Questions

What is the IUPAC name of 5-(5-phenyl-1,3,4-oxadiazol-2-yl)-1,3-thiazol-2-amine?
The IUPAC name of 5-(5-phenyl-1,3,4-oxadiazol-2-yl)-1,3-thiazol-2-amine (CID 83301136) is 5-(5-phenyl-1,3,4-oxadiazol-2-yl)-1,3-thiazol-2-amine.
What is the SMILES notation for 5-(5-phenyl-1,3,4-oxadiazol-2-yl)-1,3-thiazol-2-amine?
The canonical SMILES for 5-(5-phenyl-1,3,4-oxadiazol-2-yl)-1,3-thiazol-2-amine is Nc1ncc(-c2nnc(-c3ccccc3)o2)s1.
What is the InChIKey of 5-(5-phenyl-1,3,4-oxadiazol-2-yl)-1,3-thiazol-2-amine?
The InChIKey is QYVJNGCQMMWYSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8N4OS/c12-11-13-6-8(17-11)10-15-14-9(16-10)7-4-2-1-3-5-7/h1-6H,(H2,12,13).
What are the key properties of 5-(5-phenyl-1,3,4-oxadiazol-2-yl)-1,3-thiazol-2-amine?
5-(5-phenyl-1,3,4-oxadiazol-2-yl)-1,3-thiazol-2-amine has a molecular weight of 244.28 g/mol, XLogP of 2.44, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-phenyl-1,3,4-oxadiazol-2-yl)-1,3-thiazol-2-amine is sourced from PubChem (CID 83301136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).