N,3-dimethyl-4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)-1,2-thiazol-5-amine

C12H11N5OS — CID 79391228

IUPACN,3-dimethyl-4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)-1,2-thiazol-5-amine
SMILESCNc1snc(C)c1-c1nc(-c2cccnc2)no1
InChIInChI=1S/C12H11N5OS/c1-7-9(12(13-2)19-17-7)11-15-10(16-18-11)8-4-3-5-14-6-8/h3-6,13H,1-2H3
InChIKeyWDUOMUVXGNOMET-UHFFFAOYSA-N
MW273.32 g/mol
LogP2.61
Rot. Bonds3

About N,3-dimethyl-4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)-1,2-thiazol-5-amine

N,3-dimethyl-4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)-1,2-thiazol-5-amine (PubChem CID 79391228) has the molecular formula C12H11N5OS and a molecular weight of 273.32 g/mol. Its IUPAC name is N,3-dimethyl-4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)-1,2-thiazol-5-amine.

Molecular Properties

Compound NameN,3-dimethyl-4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)-1,2-thiazol-5-amine
PubChem CID79391228
Molecular FormulaC12H11N5OS
Molecular Weight273.32 g/mol
Exact Mass273.07
IUPAC NameN,3-dimethyl-4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)-1,2-thiazol-5-amine
SMILESCNc1snc(C)c1-c1nc(-c2cccnc2)no1
InChIInChI=1S/C12H11N5OS/c1-7-9(12(13-2)19-17-7)11-15-10(16-18-11)8-4-3-5-14-6-8/h3-6,13H,1-2H3
InChIKeyWDUOMUVXGNOMET-UHFFFAOYSA-N
XLogP2.61
TPSA76.73 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.32
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N,3-dimethyl-4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)-1,2-thiazol-5-amine with MolForge

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Related Compounds

4-[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]-N,3-dimethyl-1,2-thiazol-5-amine
CID 79392299
3-[5-[3-methyl-5-(methylamino)-1,2-thiazol-4-yl]-1,2,4-oxadiazol-3-yl]phenol
CID 107921085
4-[3-(3-chloro-2-pyridinyl)-1,2,4-oxadiazol-5-yl]-N,3-dimethyl-1,2-thiazol-5-amine
CID 103442639
4-[3-(2-bromo-4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N,3-dimethyl-1,2-thiazol-5-amine
CID 107280112
4-[3-(2-bromo-5-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N,3-dimethyl-1,2-thiazol-5-amine
CID 107923395
3-(4-methylphenyl)-5-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)-1,2,4-oxadiazole
CID 75527948
5-N-methyl-4-pyridin-3-yl-1,2-thiazole-3,5-diamine
CID 103363370
N-methyl-1-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methanamine;dihydrochloride
CID 54592854
5-(2-methoxy-4-methylpyrimidin-5-yl)-3-pyridin-3-yl-1,2,4-oxadiazole
CID 91819568
(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)hydrazine
CID 47003158
N,4-dimethyl-2-pyridin-3-yl-1,3-thiazol-5-amine
CID 59580850
N-methyl-1-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)ethanamine
CID 62627315

Frequently Asked Questions

What is the IUPAC name of N,3-dimethyl-4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)-1,2-thiazol-5-amine?
The IUPAC name of N,3-dimethyl-4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)-1,2-thiazol-5-amine (CID 79391228) is N,3-dimethyl-4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)-1,2-thiazol-5-amine.
What is the SMILES notation for N,3-dimethyl-4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)-1,2-thiazol-5-amine?
The canonical SMILES for N,3-dimethyl-4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)-1,2-thiazol-5-amine is CNc1snc(C)c1-c1nc(-c2cccnc2)no1.
What is the InChIKey of N,3-dimethyl-4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)-1,2-thiazol-5-amine?
The InChIKey is WDUOMUVXGNOMET-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N5OS/c1-7-9(12(13-2)19-17-7)11-15-10(16-18-11)8-4-3-5-14-6-8/h3-6,13H,1-2H3.
What are the key properties of N,3-dimethyl-4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)-1,2-thiazol-5-amine?
N,3-dimethyl-4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)-1,2-thiazol-5-amine has a molecular weight of 273.32 g/mol, XLogP of 2.61, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dimethyl-4-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)-1,2-thiazol-5-amine is sourced from PubChem (CID 79391228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).