1-(2-chloro-6-fluorophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylpropan-2-amine

C15H15ClFN3S — CID 115333619

IUPAC1-(2-chloro-6-fluorophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylpropan-2-amine
SMILESCNC(Cc1cn2ccsc2n1)Cc1c(F)cccc1Cl
InChIInChI=1S/C15H15ClFN3S/c1-18-10(8-12-13(16)3-2-4-14(12)17)7-11-9-20-5-6-21-15(20)19-11/h2-6,9-10,18H,7-8H2,1H3
InChIKeyVNUQVERBTPMLHH-UHFFFAOYSA-N
MW323.82 g/mol
LogP3.56
Rot. Bonds5

About 1-(2-chloro-6-fluorophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylpropan-2-amine

1-(2-chloro-6-fluorophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylpropan-2-amine (PubChem CID 115333619) has the molecular formula C15H15ClFN3S and a molecular weight of 323.82 g/mol. Its IUPAC name is 1-(2-chloro-6-fluorophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylpropan-2-amine.

Molecular Properties

Compound Name1-(2-chloro-6-fluorophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylpropan-2-amine
PubChem CID115333619
Molecular FormulaC15H15ClFN3S
Molecular Weight323.82 g/mol
Exact Mass323.07
IUPAC Name1-(2-chloro-6-fluorophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylpropan-2-amine
SMILESCNC(Cc1cn2ccsc2n1)Cc1c(F)cccc1Cl
InChIInChI=1S/C15H15ClFN3S/c1-18-10(8-12-13(16)3-2-4-14(12)17)7-11-9-20-5-6-21-15(20)19-11/h2-6,9-10,18H,7-8H2,1H3
InChIKeyVNUQVERBTPMLHH-UHFFFAOYSA-N
XLogP3.56
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.82
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2,6-difluorophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylpropan-2-amine
CID 105023533
1-(2-chlorophenyl)-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylethanamine
CID 115333568
1-(2-bromophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylpropan-2-amine
CID 115333611
4,4,4-trifluoro-1-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylbutan-2-amine
CID 113289195
1-imidazo[2,1-b][1,3]thiazol-6-yl-5-methoxy-N-methylpentan-2-amine
CID 113289221
1-(4-fluoro-3-methylphenyl)-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylethanamine
CID 115333502
[1-(3,4-dichlorophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-yl]hydrazine
CID 105210783
1-(2,5-dichlorophenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine
CID 105023602
3-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-N-methylpentan-2-amine
CID 115332363
1-(2-chloro-6-fluorophenyl)-3-(furan-2-yl)-N-methylpropan-2-amine
CID 83176029
1-(2,6-difluorophenyl)-N-methyl-3-(1-methylpyrazol-3-yl)propan-2-amine
CID 105025395
4-(2-chloro-6-fluorophenyl)-1-N,1-N,3-N-trimethylbutane-1,3-diamine
CID 113291231

Frequently Asked Questions

What is the IUPAC name of 1-(2-chloro-6-fluorophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylpropan-2-amine?
The IUPAC name of 1-(2-chloro-6-fluorophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylpropan-2-amine (CID 115333619) is 1-(2-chloro-6-fluorophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylpropan-2-amine.
What is the SMILES notation for 1-(2-chloro-6-fluorophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylpropan-2-amine?
The canonical SMILES for 1-(2-chloro-6-fluorophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylpropan-2-amine is CNC(Cc1cn2ccsc2n1)Cc1c(F)cccc1Cl.
What is the InChIKey of 1-(2-chloro-6-fluorophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylpropan-2-amine?
The InChIKey is VNUQVERBTPMLHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClFN3S/c1-18-10(8-12-13(16)3-2-4-14(12)17)7-11-9-20-5-6-21-15(20)19-11/h2-6,9-10,18H,7-8H2,1H3.
What are the key properties of 1-(2-chloro-6-fluorophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylpropan-2-amine?
1-(2-chloro-6-fluorophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylpropan-2-amine has a molecular weight of 323.82 g/mol, XLogP of 3.56, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chloro-6-fluorophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylpropan-2-amine is sourced from PubChem (CID 115333619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).