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

C7H9F3N2S — CID 106444355

IUPACN-ethyl-4-methyl-5-(trifluoromethyl)-1,3-thiazol-2-amine
SMILESCCNc1nc(C)c(C(F)(F)F)s1
InChIInChI=1S/C7H9F3N2S/c1-3-11-6-12-4(2)5(13-6)7(8,9)10/h3H2,1-2H3,(H,11,12)
InChIKeyPUJINFTZSAZVGE-UHFFFAOYSA-N
MW210.22 g/mol
LogP2.90
Rot. Bonds2

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

N-ethyl-4-methyl-5-(trifluoromethyl)-1,3-thiazol-2-amine (PubChem CID 106444355) has the molecular formula C7H9F3N2S and a molecular weight of 210.22 g/mol. Its IUPAC name is N-ethyl-4-methyl-5-(trifluoromethyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-ethyl-4-methyl-5-(trifluoromethyl)-1,3-thiazol-2-amine
PubChem CID106444355
Molecular FormulaC7H9F3N2S
Molecular Weight210.22 g/mol
Exact Mass210.04
IUPAC NameN-ethyl-4-methyl-5-(trifluoromethyl)-1,3-thiazol-2-amine
SMILESCCNc1nc(C)c(C(F)(F)F)s1
InChIInChI=1S/C7H9F3N2S/c1-3-11-6-12-4(2)5(13-6)7(8,9)10/h3H2,1-2H3,(H,11,12)
InChIKeyPUJINFTZSAZVGE-UHFFFAOYSA-N
XLogP2.90
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.22
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-Amino-4,5-dimethyl-1,3-thiazole
CID 73238
1-(Dimethyl-1,3-thiazol-2-yl)piperazine
CID 19915765
5-Methyl-4-(trifluoromethyl)-1,3-thiazol-2-amine
CID 53418534
4-Methyl-5-(trifluoromethyl)-1,3-thiazol-2-amine
CID 72214384
N,N,4,5-tetramethyl-1,3-thiazol-2-amine
CID 12910389
N,4,5-trimethyl-1,3-thiazol-2-amine
CID 17763823
N-(4,5-dimethyl-1,3-thiazol-2-yl)-N'-isopropylurea
CID 16654058
2-[2-(4,5-Dimethyl-1,3-thiazol-2-yl)ethyl]-1,3-diethylguanidine
CID 86779365
N-ethyl-4-(trifluoromethyl)-1,3-thiazol-2-amine
CID 178203
N-propan-2-yl-4-(trifluoromethyl)-1,3-thiazol-2-amine
CID 178205
1-(4-Methyl-5-trifluoromethyl-thiazol-2-yl)-piperazine hydrochloride
CID 21100177
4-Methyl-2-piperazin-1-yl-5-(trifluoromethyl)-1,3-thiazole
CID 21100178

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-methyl-5-(trifluoromethyl)-1,3-thiazol-2-amine?
The IUPAC name of N-ethyl-4-methyl-5-(trifluoromethyl)-1,3-thiazol-2-amine (CID 106444355) is N-ethyl-4-methyl-5-(trifluoromethyl)-1,3-thiazol-2-amine.
What is the SMILES notation for N-ethyl-4-methyl-5-(trifluoromethyl)-1,3-thiazol-2-amine?
The canonical SMILES for N-ethyl-4-methyl-5-(trifluoromethyl)-1,3-thiazol-2-amine is CCNc1nc(C)c(C(F)(F)F)s1.
What is the InChIKey of N-ethyl-4-methyl-5-(trifluoromethyl)-1,3-thiazol-2-amine?
The InChIKey is PUJINFTZSAZVGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9F3N2S/c1-3-11-6-12-4(2)5(13-6)7(8,9)10/h3H2,1-2H3,(H,11,12).
What are the key properties of N-ethyl-4-methyl-5-(trifluoromethyl)-1,3-thiazol-2-amine?
N-ethyl-4-methyl-5-(trifluoromethyl)-1,3-thiazol-2-amine has a molecular weight of 210.22 g/mol, XLogP of 2.90, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-methyl-5-(trifluoromethyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 106444355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).