N,N,5-trimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine

C7H9F3N2S — CID 70658294

IUPACN,N,5-trimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine
SMILESCc1sc(N(C)C)nc1C(F)(F)F
InChIInChI=1S/C7H9F3N2S/c1-4-5(7(8,9)10)11-6(13-4)12(2)3/h1-3H3
InChIKeyHQJHTIJAYPUOHD-UHFFFAOYSA-N
MW210.22 g/mol
LogP2.54
Rot. Bonds1

About N,N,5-trimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine

N,N,5-trimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine (PubChem CID 70658294) has the molecular formula C7H9F3N2S and a molecular weight of 210.22 g/mol. Its IUPAC name is N,N,5-trimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN,N,5-trimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine
PubChem CID70658294
Molecular FormulaC7H9F3N2S
Molecular Weight210.22 g/mol
Exact Mass210.04
IUPAC NameN,N,5-trimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine
SMILESCc1sc(N(C)C)nc1C(F)(F)F
InChIInChI=1S/C7H9F3N2S/c1-4-5(7(8,9)10)11-6(13-4)12(2)3/h1-3H3
InChIKeyHQJHTIJAYPUOHD-UHFFFAOYSA-N
XLogP2.54
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.22
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N,5-trimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine?
The IUPAC name of N,N,5-trimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine (CID 70658294) is N,N,5-trimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine.
What is the SMILES notation for N,N,5-trimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine?
The canonical SMILES for N,N,5-trimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine is Cc1sc(N(C)C)nc1C(F)(F)F.
What is the InChIKey of N,N,5-trimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine?
The InChIKey is HQJHTIJAYPUOHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9F3N2S/c1-4-5(7(8,9)10)11-6(13-4)12(2)3/h1-3H3.
What are the key properties of N,N,5-trimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine?
N,N,5-trimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine has a molecular weight of 210.22 g/mol, XLogP of 2.54, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,5-trimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 70658294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).