[4-cyclopropyl-2-[methyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol

C10H13F3N2OS — CID 63916841

IUPAC[4-cyclopropyl-2-[methyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol
SMILESCN(CC(F)(F)F)c1nc(C2CC2)c(CO)s1
InChIInChI=1S/C10H13F3N2OS/c1-15(5-10(11,12)13)9-14-8(6-2-3-6)7(4-16)17-9/h6,16H,2-5H2,1H3
InChIKeyXMBKMVOSNZNTPJ-UHFFFAOYSA-N
MW266.29 g/mol
LogP2.51
Rot. Bonds4

About [4-cyclopropyl-2-[methyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol

[4-cyclopropyl-2-[methyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol (PubChem CID 63916841) has the molecular formula C10H13F3N2OS and a molecular weight of 266.29 g/mol. Its IUPAC name is [4-cyclopropyl-2-[methyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol.

Molecular Properties

Compound Name[4-cyclopropyl-2-[methyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol
PubChem CID63916841
Molecular FormulaC10H13F3N2OS
Molecular Weight266.29 g/mol
Exact Mass266.07
IUPAC Name[4-cyclopropyl-2-[methyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol
SMILESCN(CC(F)(F)F)c1nc(C2CC2)c(CO)s1
InChIInChI=1S/C10H13F3N2OS/c1-15(5-10(11,12)13)9-14-8(6-2-3-6)7(4-16)17-9/h6,16H,2-5H2,1H3
InChIKeyXMBKMVOSNZNTPJ-UHFFFAOYSA-N
XLogP2.51
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.29
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [4-cyclopropyl-2-[methyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [4-cyclopropyl-2-[methyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol?
The IUPAC name of [4-cyclopropyl-2-[methyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol (CID 63916841) is [4-cyclopropyl-2-[methyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol.
What is the SMILES notation for [4-cyclopropyl-2-[methyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol?
The canonical SMILES for [4-cyclopropyl-2-[methyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol is CN(CC(F)(F)F)c1nc(C2CC2)c(CO)s1.
What is the InChIKey of [4-cyclopropyl-2-[methyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol?
The InChIKey is XMBKMVOSNZNTPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13F3N2OS/c1-15(5-10(11,12)13)9-14-8(6-2-3-6)7(4-16)17-9/h6,16H,2-5H2,1H3.
What are the key properties of [4-cyclopropyl-2-[methyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol?
[4-cyclopropyl-2-[methyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol has a molecular weight of 266.29 g/mol, XLogP of 2.51, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-cyclopropyl-2-[methyl(2,2,2-trifluoroethyl)amino]-1,3-thiazol-5-yl]methanol is sourced from PubChem (CID 63916841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).