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

C11H10N6OS — CID 79392407

IUPACN,3-dimethyl-4-(3-pyrimidin-2-yl-1,2,4-oxadiazol-5-yl)-1,2-thiazol-5-amine
SMILESCNc1snc(C)c1-c1nc(-c2ncccn2)no1
InChIInChI=1S/C11H10N6OS/c1-6-7(11(12-2)19-17-6)10-15-9(16-18-10)8-13-4-3-5-14-8/h3-5,12H,1-2H3
InChIKeyRFDMOGVYSJTVSI-UHFFFAOYSA-N
MW274.31 g/mol
LogP2.00
Rot. Bonds3

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

N,3-dimethyl-4-(3-pyrimidin-2-yl-1,2,4-oxadiazol-5-yl)-1,2-thiazol-5-amine (PubChem CID 79392407) has the molecular formula C11H10N6OS and a molecular weight of 274.31 g/mol. Its IUPAC name is N,3-dimethyl-4-(3-pyrimidin-2-yl-1,2,4-oxadiazol-5-yl)-1,2-thiazol-5-amine.

Molecular Properties

Compound NameN,3-dimethyl-4-(3-pyrimidin-2-yl-1,2,4-oxadiazol-5-yl)-1,2-thiazol-5-amine
PubChem CID79392407
Molecular FormulaC11H10N6OS
Molecular Weight274.31 g/mol
Exact Mass274.06
IUPAC NameN,3-dimethyl-4-(3-pyrimidin-2-yl-1,2,4-oxadiazol-5-yl)-1,2-thiazol-5-amine
SMILESCNc1snc(C)c1-c1nc(-c2ncccn2)no1
InChIInChI=1S/C11H10N6OS/c1-6-7(11(12-2)19-17-6)10-15-9(16-18-10)8-13-4-3-5-14-8/h3-5,12H,1-2H3
InChIKeyRFDMOGVYSJTVSI-UHFFFAOYSA-N
XLogP2.00
TPSA89.62 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.31
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of N,3-dimethyl-4-(3-pyrimidin-2-yl-1,2,4-oxadiazol-5-yl)-1,2-thiazol-5-amine?
The IUPAC name of N,3-dimethyl-4-(3-pyrimidin-2-yl-1,2,4-oxadiazol-5-yl)-1,2-thiazol-5-amine (CID 79392407) is N,3-dimethyl-4-(3-pyrimidin-2-yl-1,2,4-oxadiazol-5-yl)-1,2-thiazol-5-amine.
What is the SMILES notation for N,3-dimethyl-4-(3-pyrimidin-2-yl-1,2,4-oxadiazol-5-yl)-1,2-thiazol-5-amine?
The canonical SMILES for N,3-dimethyl-4-(3-pyrimidin-2-yl-1,2,4-oxadiazol-5-yl)-1,2-thiazol-5-amine is CNc1snc(C)c1-c1nc(-c2ncccn2)no1.
What is the InChIKey of N,3-dimethyl-4-(3-pyrimidin-2-yl-1,2,4-oxadiazol-5-yl)-1,2-thiazol-5-amine?
The InChIKey is RFDMOGVYSJTVSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N6OS/c1-6-7(11(12-2)19-17-6)10-15-9(16-18-10)8-13-4-3-5-14-8/h3-5,12H,1-2H3.
What are the key properties of N,3-dimethyl-4-(3-pyrimidin-2-yl-1,2,4-oxadiazol-5-yl)-1,2-thiazol-5-amine?
N,3-dimethyl-4-(3-pyrimidin-2-yl-1,2,4-oxadiazol-5-yl)-1,2-thiazol-5-amine has a molecular weight of 274.31 g/mol, XLogP of 2.00, 3 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dimethyl-4-(3-pyrimidin-2-yl-1,2,4-oxadiazol-5-yl)-1,2-thiazol-5-amine is sourced from PubChem (CID 79392407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).