4,4,4-trifluoro-1-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylbutan-2-amine

C10H12F3N3S — CID 113289195

IUPAC4,4,4-trifluoro-1-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylbutan-2-amine
SMILESCNC(Cc1cn2ccsc2n1)CC(F)(F)F
InChIInChI=1S/C10H12F3N3S/c1-14-7(5-10(11,12)13)4-8-6-16-2-3-17-9(16)15-8/h2-3,6-7,14H,4-5H2,1H3
InChIKeyGZUMWHFETJKMOS-UHFFFAOYSA-N
MW263.29 g/mol
LogP2.48
Rot. Bonds4

About 4,4,4-trifluoro-1-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylbutan-2-amine

4,4,4-trifluoro-1-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylbutan-2-amine (PubChem CID 113289195) has the molecular formula C10H12F3N3S and a molecular weight of 263.29 g/mol. Its IUPAC name is 4,4,4-trifluoro-1-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylbutan-2-amine.

Molecular Properties

Compound Name4,4,4-trifluoro-1-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylbutan-2-amine
PubChem CID113289195
Molecular FormulaC10H12F3N3S
Molecular Weight263.29 g/mol
Exact Mass263.07
IUPAC Name4,4,4-trifluoro-1-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylbutan-2-amine
SMILESCNC(Cc1cn2ccsc2n1)CC(F)(F)F
InChIInChI=1S/C10H12F3N3S/c1-14-7(5-10(11,12)13)4-8-6-16-2-3-17-9(16)15-8/h2-3,6-7,14H,4-5H2,1H3
InChIKeyGZUMWHFETJKMOS-UHFFFAOYSA-N
XLogP2.48
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.29
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-imidazo[2,1-b][1,3]thiazol-6-yl-1-N,1-N,2-N-trimethylpropane-1,2-diamine
CID 115333859
1-(2,6-difluorophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylpropan-2-amine
CID 105023533
1-imidazo[2,1-b][1,3]thiazol-6-yl-5-methoxy-N-methylpentan-2-amine
CID 113289221
1-(2-bromophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylpropan-2-amine
CID 115333611
1-(2-chloro-6-fluorophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylpropan-2-amine
CID 115333619
3-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-N-methylpentan-2-amine
CID 115332363
3-ethoxy-1-imidazo[2,1-b][1,3]thiazol-6-yl-N,3-dimethylpentan-2-amine
CID 116758969
2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methyl-1-(2,4,6-trimethylphenyl)ethanamine
CID 105023446
(1-ethoxy-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-yl)hydrazine
CID 105235209
[1-imidazo[2,1-b][1,3]thiazol-6-yl-3-(2-methyl-1,3-thiazol-4-yl)propan-2-yl]hydrazine
CID 105214580
(1-imidazo[2,1-b][1,3]thiazol-6-yl-4-methoxybutan-2-yl)hydrazine
CID 105206256
1-(1,5-dimethylpyrazol-4-yl)-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylethanamine
CID 105174084

Frequently Asked Questions

What is the IUPAC name of 4,4,4-trifluoro-1-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylbutan-2-amine?
The IUPAC name of 4,4,4-trifluoro-1-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylbutan-2-amine (CID 113289195) is 4,4,4-trifluoro-1-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylbutan-2-amine.
What is the SMILES notation for 4,4,4-trifluoro-1-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylbutan-2-amine?
The canonical SMILES for 4,4,4-trifluoro-1-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylbutan-2-amine is CNC(Cc1cn2ccsc2n1)CC(F)(F)F.
What is the InChIKey of 4,4,4-trifluoro-1-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylbutan-2-amine?
The InChIKey is GZUMWHFETJKMOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F3N3S/c1-14-7(5-10(11,12)13)4-8-6-16-2-3-17-9(16)15-8/h2-3,6-7,14H,4-5H2,1H3.
What are the key properties of 4,4,4-trifluoro-1-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylbutan-2-amine?
4,4,4-trifluoro-1-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylbutan-2-amine has a molecular weight of 263.29 g/mol, XLogP of 2.48, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4,4-trifluoro-1-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylbutan-2-amine is sourced from PubChem (CID 113289195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).