1-(2,5-dichlorophenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine

C13H11Cl2N3S — CID 105023602

IUPAC1-(2,5-dichlorophenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine
SMILESNC(Cc1cn2ccsc2n1)c1cc(Cl)ccc1Cl
InChIInChI=1S/C13H11Cl2N3S/c14-8-1-2-11(15)10(5-8)12(16)6-9-7-18-3-4-19-13(18)17-9/h1-5,7,12H,6,16H2
InChIKeyLZQNZXMDEAINBQ-UHFFFAOYSA-N
MW312.23 g/mol
LogP3.95
Rot. Bonds3

About 1-(2,5-dichlorophenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine

1-(2,5-dichlorophenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine (PubChem CID 105023602) has the molecular formula C13H11Cl2N3S and a molecular weight of 312.23 g/mol. Its IUPAC name is 1-(2,5-dichlorophenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine.

Molecular Properties

Compound Name1-(2,5-dichlorophenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine
PubChem CID105023602
Molecular FormulaC13H11Cl2N3S
Molecular Weight312.23 g/mol
Exact Mass311.01
IUPAC Name1-(2,5-dichlorophenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine
SMILESNC(Cc1cn2ccsc2n1)c1cc(Cl)ccc1Cl
InChIInChI=1S/C13H11Cl2N3S/c14-8-1-2-11(15)10(5-8)12(16)6-9-7-18-3-4-19-13(18)17-9/h1-5,7,12H,6,16H2
InChIKeyLZQNZXMDEAINBQ-UHFFFAOYSA-N
XLogP3.95
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.23
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-bromo-2-fluorophenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine
CID 114906198
2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(4-propan-2-ylphenyl)ethanamine
CID 115333398
2-imidazo[2,1-b][1,3]thiazol-6-yl-1-pyrimidin-2-ylethanamine
CID 115333425
2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(2-methoxy-5-methylphenyl)ethanamine
CID 105023464
1-(2,4-dichlorophenyl)-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)ethanamine
CID 78918734
2-imidazo[2,1-b][1,3]thiazol-6-yl-1-pyrazolo[1,5-a]pyridin-3-ylethanamine
CID 103127935
[1-(3,4-dichlorophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-yl]hydrazine
CID 105210783
1-(3-chlorophenyl)sulfanyl-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-amine
CID 115333797
4-chloro-2-(imidazo[2,1-b][1,3]thiazol-6-ylmethylsulfanyl)aniline
CID 115332050
5-chloro-2-(imidazo[2,1-b][1,3]thiazol-6-ylmethylsulfanyl)aniline
CID 115332020
1-(4-tert-butylphenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine
CID 105023719
1-(5-bromothiophen-2-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine
CID 115333678

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-dichlorophenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine?
The IUPAC name of 1-(2,5-dichlorophenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine (CID 105023602) is 1-(2,5-dichlorophenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine.
What is the SMILES notation for 1-(2,5-dichlorophenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine?
The canonical SMILES for 1-(2,5-dichlorophenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine is NC(Cc1cn2ccsc2n1)c1cc(Cl)ccc1Cl.
What is the InChIKey of 1-(2,5-dichlorophenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine?
The InChIKey is LZQNZXMDEAINBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11Cl2N3S/c14-8-1-2-11(15)10(5-8)12(16)6-9-7-18-3-4-19-13(18)17-9/h1-5,7,12H,6,16H2.
What are the key properties of 1-(2,5-dichlorophenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine?
1-(2,5-dichlorophenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine has a molecular weight of 312.23 g/mol, XLogP of 3.95, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-dichlorophenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine is sourced from PubChem (CID 105023602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).