2-(1,1,1-trifluoropropan-2-yloxy)-1,3-thiazol-5-amine

C6H7F3N2OS — CID 102769545

IUPAC2-(1,1,1-trifluoropropan-2-yloxy)-1,3-thiazol-5-amine
SMILESCC(Oc1ncc(N)s1)C(F)(F)F
InChIInChI=1S/C6H7F3N2OS/c1-3(6(7,8)9)12-5-11-2-4(10)13-5/h2-3H,10H2,1H3
InChIKeyIFYCJFUVSZVXGI-UHFFFAOYSA-N
MW212.20 g/mol
LogP2.05
Rot. Bonds2

About 2-(1,1,1-trifluoropropan-2-yloxy)-1,3-thiazol-5-amine

2-(1,1,1-trifluoropropan-2-yloxy)-1,3-thiazol-5-amine (PubChem CID 102769545) has the molecular formula C6H7F3N2OS and a molecular weight of 212.20 g/mol. Its IUPAC name is 2-(1,1,1-trifluoropropan-2-yloxy)-1,3-thiazol-5-amine.

Molecular Properties

Compound Name2-(1,1,1-trifluoropropan-2-yloxy)-1,3-thiazol-5-amine
PubChem CID102769545
Molecular FormulaC6H7F3N2OS
Molecular Weight212.20 g/mol
Exact Mass212.02
IUPAC Name2-(1,1,1-trifluoropropan-2-yloxy)-1,3-thiazol-5-amine
SMILESCC(Oc1ncc(N)s1)C(F)(F)F
InChIInChI=1S/C6H7F3N2OS/c1-3(6(7,8)9)12-5-11-2-4(10)13-5/h2-3H,10H2,1H3
InChIKeyIFYCJFUVSZVXGI-UHFFFAOYSA-N
XLogP2.05
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.20
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

tert-butyl N-[2-(2,2,2-trifluoroethoxy)-1,3-thiazol-5-yl]carbamate
CID 154729526
2-(2,2,2-Trifluoroethoxy)-1,3-thiazol-5-amine
CID 102769230
2-(2,2,3,3-Tetrafluoropropoxy)-1,3-thiazol-5-amine
CID 102769383
2-(2,2,3,3,3-Pentafluoropropoxy)-1,3-thiazol-5-amine
CID 102769551
2-(2,2-Difluoroethoxy)-1,3-thiazol-5-amine
CID 102769587
2-(4,4,4-Trifluorobutoxy)-1,3-thiazol-5-amine
CID 102769591
2-(3,3,3-Trifluoropropoxy)-1,3-thiazol-5-amine
CID 102769599
2-(1,1,1,3,3,3-Hexafluoropropan-2-yloxy)-1,3-thiazol-5-amine
CID 102769638
2-[(1,1,1-Trifluoropropan-2-yl)oxy]-1,3-thiazole
CID 126954000
2-(2,2-Difluoropropoxy)-1,3-thiazol-5-amine
CID 165962999
5-Amino-2-(methoxy)thiazole
CID 20459849
5-Amino-2-(iso-propoxy)thiazole
CID 66520563

Frequently Asked Questions

What is the IUPAC name of 2-(1,1,1-trifluoropropan-2-yloxy)-1,3-thiazol-5-amine?
The IUPAC name of 2-(1,1,1-trifluoropropan-2-yloxy)-1,3-thiazol-5-amine (CID 102769545) is 2-(1,1,1-trifluoropropan-2-yloxy)-1,3-thiazol-5-amine.
What is the SMILES notation for 2-(1,1,1-trifluoropropan-2-yloxy)-1,3-thiazol-5-amine?
The canonical SMILES for 2-(1,1,1-trifluoropropan-2-yloxy)-1,3-thiazol-5-amine is CC(Oc1ncc(N)s1)C(F)(F)F.
What is the InChIKey of 2-(1,1,1-trifluoropropan-2-yloxy)-1,3-thiazol-5-amine?
The InChIKey is IFYCJFUVSZVXGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7F3N2OS/c1-3(6(7,8)9)12-5-11-2-4(10)13-5/h2-3H,10H2,1H3.
What are the key properties of 2-(1,1,1-trifluoropropan-2-yloxy)-1,3-thiazol-5-amine?
2-(1,1,1-trifluoropropan-2-yloxy)-1,3-thiazol-5-amine has a molecular weight of 212.20 g/mol, XLogP of 2.05, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,1,1-trifluoropropan-2-yloxy)-1,3-thiazol-5-amine is sourced from PubChem (CID 102769545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).