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

C6H7F3N2S — CID 2512903

IUPACN,N-dimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine
SMILESCN(C)c1nc(C(F)(F)F)cs1
InChIInChI=1S/C6H7F3N2S/c1-11(2)5-10-4(3-12-5)6(7,8)9/h3H,1-2H3
InChIKeyAGLVCEINBDIMGZ-UHFFFAOYSA-N
MW196.20 g/mol
LogP2.23
Rot. Bonds1

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

N,N-dimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine (PubChem CID 2512903) has the molecular formula C6H7F3N2S and a molecular weight of 196.20 g/mol. Its IUPAC name is N,N-dimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN,N-dimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine
PubChem CID2512903
Molecular FormulaC6H7F3N2S
Molecular Weight196.20 g/mol
Exact Mass196.03
IUPAC NameN,N-dimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine
SMILESCN(C)c1nc(C(F)(F)F)cs1
InChIInChI=1S/C6H7F3N2S/c1-11(2)5-10-4(3-12-5)6(7,8)9/h3H,1-2H3
InChIKeyAGLVCEINBDIMGZ-UHFFFAOYSA-N
XLogP2.23
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.20
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine?
The IUPAC name of N,N-dimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine (CID 2512903) is N,N-dimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine.
What is the SMILES notation for N,N-dimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine?
The canonical SMILES for N,N-dimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine is CN(C)c1nc(C(F)(F)F)cs1.
What is the InChIKey of N,N-dimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine?
The InChIKey is AGLVCEINBDIMGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7F3N2S/c1-11(2)5-10-4(3-12-5)6(7,8)9/h3H,1-2H3.
What are the key properties of N,N-dimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine?
N,N-dimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine has a molecular weight of 196.20 g/mol, XLogP of 2.23, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 2512903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).