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

C15H16BrN3S — CID 115333611

IUPAC1-(2-bromophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylpropan-2-amine
SMILESCNC(Cc1cn2ccsc2n1)Cc1ccccc1Br
InChIInChI=1S/C15H16BrN3S/c1-17-12(8-11-4-2-3-5-14(11)16)9-13-10-19-6-7-20-15(19)18-13/h2-7,10,12,17H,8-9H2,1H3
InChIKeyMQWAABRWMJLYEG-UHFFFAOYSA-N
MW350.29 g/mol
LogP3.53
Rot. Bonds5

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

1-(2-bromophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylpropan-2-amine (PubChem CID 115333611) has the molecular formula C15H16BrN3S and a molecular weight of 350.29 g/mol. Its IUPAC name is 1-(2-bromophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylpropan-2-amine.

Molecular Properties

Compound Name1-(2-bromophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylpropan-2-amine
PubChem CID115333611
Molecular FormulaC15H16BrN3S
Molecular Weight350.29 g/mol
Exact Mass349.02
IUPAC Name1-(2-bromophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylpropan-2-amine
SMILESCNC(Cc1cn2ccsc2n1)Cc1ccccc1Br
InChIInChI=1S/C15H16BrN3S/c1-17-12(8-11-4-2-3-5-14(11)16)9-13-10-19-6-7-20-15(19)18-13/h2-7,10,12,17H,8-9H2,1H3
InChIKeyMQWAABRWMJLYEG-UHFFFAOYSA-N
XLogP3.53
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.29
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(2-bromophenyl)methyl]-3-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylpropan-1-amine
CID 115334298
1-(2,6-difluorophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylpropan-2-amine
CID 105023533
4,4,4-trifluoro-1-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylbutan-2-amine
CID 113289195
1-(2-chloro-6-fluorophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylpropan-2-amine
CID 115333619
6-[2-(bromomethyl)-3-(2-methylphenyl)propyl]imidazo[2,1-b][1,3]thiazole
CID 115335208
1-imidazo[2,1-b][1,3]thiazol-6-yl-5-methoxy-N-methylpentan-2-amine
CID 113289221
1-(2-chlorophenyl)-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylethanamine
CID 115333568
[1-(4-bromophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-yl]hydrazine
CID 105195463
3-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-N-methylpentan-2-amine
CID 115332363
(1-ethoxy-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-yl)hydrazine
CID 105235209
2-[(2-fluorophenyl)methyl]-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-1-amine
CID 115334246
6-(3-bromo-2-methylpropyl)imidazo[2,1-b][1,3]thiazole
CID 115335190

Frequently Asked Questions

What is the IUPAC name of 1-(2-bromophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylpropan-2-amine?
The IUPAC name of 1-(2-bromophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylpropan-2-amine (CID 115333611) is 1-(2-bromophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylpropan-2-amine.
What is the SMILES notation for 1-(2-bromophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylpropan-2-amine?
The canonical SMILES for 1-(2-bromophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylpropan-2-amine is CNC(Cc1cn2ccsc2n1)Cc1ccccc1Br.
What is the InChIKey of 1-(2-bromophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylpropan-2-amine?
The InChIKey is MQWAABRWMJLYEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16BrN3S/c1-17-12(8-11-4-2-3-5-14(11)16)9-13-10-19-6-7-20-15(19)18-13/h2-7,10,12,17H,8-9H2,1H3.
What are the key properties of 1-(2-bromophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylpropan-2-amine?
1-(2-bromophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylpropan-2-amine has a molecular weight of 350.29 g/mol, XLogP of 3.53, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-bromophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylpropan-2-amine is sourced from PubChem (CID 115333611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).