4-methyl-5-(trifluoromethylsulfanyl)-1,3-thiazol-2-amine

C5H5F3N2S2 — CID 43625015

IUPAC4-methyl-5-(trifluoromethylsulfanyl)-1,3-thiazol-2-amine
SMILESCc1nc(N)sc1SC(F)(F)F
InChIInChI=1S/C5H5F3N2S2/c1-2-3(11-4(9)10-2)12-5(6,7)8/h1H3,(H2,9,10)
InChIKeyVBENDKJHOYQJHN-UHFFFAOYSA-N
MW214.24 g/mol
LogP2.65
Rot. Bonds1

About 4-methyl-5-(trifluoromethylsulfanyl)-1,3-thiazol-2-amine

4-methyl-5-(trifluoromethylsulfanyl)-1,3-thiazol-2-amine (PubChem CID 43625015) has the molecular formula C5H5F3N2S2 and a molecular weight of 214.24 g/mol. Its IUPAC name is 4-methyl-5-(trifluoromethylsulfanyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-methyl-5-(trifluoromethylsulfanyl)-1,3-thiazol-2-amine
PubChem CID43625015
Molecular FormulaC5H5F3N2S2
Molecular Weight214.24 g/mol
Exact Mass213.98
IUPAC Name4-methyl-5-(trifluoromethylsulfanyl)-1,3-thiazol-2-amine
SMILESCc1nc(N)sc1SC(F)(F)F
InChIInChI=1S/C5H5F3N2S2/c1-2-3(11-4(9)10-2)12-5(6,7)8/h1H3,(H2,9,10)
InChIKeyVBENDKJHOYQJHN-UHFFFAOYSA-N
XLogP2.65
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.24
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-Thiazolamine, 4-(trifluoromethyl)-
CID 1201417
5-Thiazolesulfonylfluoride, 2-amino-4-methyl-
CID 270743
5-Iodo-4-(trifluoromethyl)-1,3-thiazol-2-amine
CID 22717671
2-[(2-Amino-4-methyl-1,3-thiazol-5-yl)selanyl]acetonitrile
CID 155522273
4-Methyl-5-(methylsulfanyl)-1,3-thiazol-2-amine
CID 18735264
5-Fluoro-4-methyl-1,3-thiazol-2-amine
CID 45121649
5-Methyl-4-(trifluoromethyl)-1,3-thiazol-2-amine
CID 53418534
4-Methyl-5-(trifluoromethyl)-1,3-thiazol-2-amine
CID 72214384
4-(Difluoromethyl)-1,3-thiazol-2-amine hydrochloride
CID 117274215
2-((2-Amino-4-methyl-1,3-thiazol-5-yl)sulfanyl)acetonitrile
CID 24706792
5-Iodo-4-methyl-2-thiazolamine
CID 23341795
2-Amino-4-methyl-5-thiazolyl thiocyanate
CID 57883615

Frequently Asked Questions

What is the IUPAC name of 4-methyl-5-(trifluoromethylsulfanyl)-1,3-thiazol-2-amine?
The IUPAC name of 4-methyl-5-(trifluoromethylsulfanyl)-1,3-thiazol-2-amine (CID 43625015) is 4-methyl-5-(trifluoromethylsulfanyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-methyl-5-(trifluoromethylsulfanyl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-methyl-5-(trifluoromethylsulfanyl)-1,3-thiazol-2-amine is Cc1nc(N)sc1SC(F)(F)F.
What is the InChIKey of 4-methyl-5-(trifluoromethylsulfanyl)-1,3-thiazol-2-amine?
The InChIKey is VBENDKJHOYQJHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5F3N2S2/c1-2-3(11-4(9)10-2)12-5(6,7)8/h1H3,(H2,9,10).
What are the key properties of 4-methyl-5-(trifluoromethylsulfanyl)-1,3-thiazol-2-amine?
4-methyl-5-(trifluoromethylsulfanyl)-1,3-thiazol-2-amine has a molecular weight of 214.24 g/mol, XLogP of 2.65, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-5-(trifluoromethylsulfanyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 43625015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).