[2-[ethyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol

C8H11F3N2OS — CID 62753345

IUPAC[2-[ethyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol
SMILESCCN(CC(F)(F)F)c1ncc(CO)s1
InChIInChI=1S/C8H11F3N2OS/c1-2-13(5-8(9,10)11)7-12-3-6(4-14)15-7/h3,14H,2,4-5H2,1H3
InChIKeyGLNGFAMKGLSPJC-UHFFFAOYSA-N
MW240.25 g/mol
LogP2.02
Rot. Bonds4

About [2-[ethyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol

[2-[ethyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol (PubChem CID 62753345) has the molecular formula C8H11F3N2OS and a molecular weight of 240.25 g/mol. Its IUPAC name is [2-[ethyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol.

Molecular Properties

Compound Name[2-[ethyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol
PubChem CID62753345
Molecular FormulaC8H11F3N2OS
Molecular Weight240.25 g/mol
Exact Mass240.05
IUPAC Name[2-[ethyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol
SMILESCCN(CC(F)(F)F)c1ncc(CO)s1
InChIInChI=1S/C8H11F3N2OS/c1-2-13(5-8(9,10)11)7-12-3-6(4-14)15-7/h3,14H,2,4-5H2,1H3
InChIKeyGLNGFAMKGLSPJC-UHFFFAOYSA-N
XLogP2.02
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.25
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [2-[ethyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol?
The IUPAC name of [2-[ethyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol (CID 62753345) is [2-[ethyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol.
What is the SMILES notation for [2-[ethyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol?
The canonical SMILES for [2-[ethyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol is CCN(CC(F)(F)F)c1ncc(CO)s1.
What is the InChIKey of [2-[ethyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol?
The InChIKey is GLNGFAMKGLSPJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11F3N2OS/c1-2-13(5-8(9,10)11)7-12-3-6(4-14)15-7/h3,14H,2,4-5H2,1H3.
What are the key properties of [2-[ethyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol?
[2-[ethyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol has a molecular weight of 240.25 g/mol, XLogP of 2.02, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[ethyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol is sourced from PubChem (CID 62753345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).