5-tert-butyl-N,N-dimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine

C10H15F3N2S — CID 58486410

IUPAC5-tert-butyl-N,N-dimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine
SMILESCN(C)c1nc(C(F)(F)F)c(C(C)(C)C)s1
InChIInChI=1S/C10H15F3N2S/c1-9(2,3)7-6(10(11,12)13)14-8(16-7)15(4)5/h1-5H3
InChIKeyNVUUPJOLOXKTLJ-UHFFFAOYSA-N
MW252.30 g/mol
LogP3.53
Rot. Bonds1

About 5-tert-butyl-N,N-dimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine

5-tert-butyl-N,N-dimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine (PubChem CID 58486410) has the molecular formula C10H15F3N2S and a molecular weight of 252.30 g/mol. Its IUPAC name is 5-tert-butyl-N,N-dimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-tert-butyl-N,N-dimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine
PubChem CID58486410
Molecular FormulaC10H15F3N2S
Molecular Weight252.30 g/mol
Exact Mass252.09
IUPAC Name5-tert-butyl-N,N-dimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine
SMILESCN(C)c1nc(C(F)(F)F)c(C(C)(C)C)s1
InChIInChI=1S/C10H15F3N2S/c1-9(2,3)7-6(10(11,12)13)14-8(16-7)15(4)5/h1-5H3
InChIKeyNVUUPJOLOXKTLJ-UHFFFAOYSA-N
XLogP3.53
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.30
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-tert-butyl-N,N-dimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine?
The IUPAC name of 5-tert-butyl-N,N-dimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine (CID 58486410) is 5-tert-butyl-N,N-dimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 5-tert-butyl-N,N-dimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine?
The canonical SMILES for 5-tert-butyl-N,N-dimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine is CN(C)c1nc(C(F)(F)F)c(C(C)(C)C)s1.
What is the InChIKey of 5-tert-butyl-N,N-dimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine?
The InChIKey is NVUUPJOLOXKTLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15F3N2S/c1-9(2,3)7-6(10(11,12)13)14-8(16-7)15(4)5/h1-5H3.
What are the key properties of 5-tert-butyl-N,N-dimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine?
5-tert-butyl-N,N-dimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine has a molecular weight of 252.30 g/mol, XLogP of 3.53, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-tert-butyl-N,N-dimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 58486410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).