1-(3-ethylcyclohexyl)-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylethanamine

C16H25N3S — CID 115333760

IUPAC1-(3-ethylcyclohexyl)-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylethanamine
SMILESCCC1CCCC(C(Cc2cn3ccsc3n2)NC)C1
InChIInChI=1S/C16H25N3S/c1-3-12-5-4-6-13(9-12)15(17-2)10-14-11-19-7-8-20-16(19)18-14/h7-8,11-13,15,17H,3-6,9-10H2,1-2H3
InChIKeyLLQRRDAIMQDZQT-UHFFFAOYSA-N
MW291.46 g/mol
LogP3.74
Rot. Bonds5

About 1-(3-ethylcyclohexyl)-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylethanamine

1-(3-ethylcyclohexyl)-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylethanamine (PubChem CID 115333760) has the molecular formula C16H25N3S and a molecular weight of 291.46 g/mol. Its IUPAC name is 1-(3-ethylcyclohexyl)-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylethanamine.

Molecular Properties

Compound Name1-(3-ethylcyclohexyl)-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylethanamine
PubChem CID115333760
Molecular FormulaC16H25N3S
Molecular Weight291.46 g/mol
Exact Mass291.18
IUPAC Name1-(3-ethylcyclohexyl)-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylethanamine
SMILESCCC1CCCC(C(Cc2cn3ccsc3n2)NC)C1
InChIInChI=1S/C16H25N3S/c1-3-12-5-4-6-13(9-12)15(17-2)10-14-11-19-7-8-20-16(19)18-14/h7-8,11-13,15,17H,3-6,9-10H2,1-2H3
InChIKeyLLQRRDAIMQDZQT-UHFFFAOYSA-N
XLogP3.74
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.46
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[1-(3-ethylcyclopentyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethyl]hydrazine
CID 105233423
N-ethyl-1-(3-ethylcyclopentyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine
CID 115333767
2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methyl-1-(oxan-4-yl)ethanamine
CID 115333735
[2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)ethyl]hydrazine
CID 105265716
1-cycloheptyl-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol
CID 115332915
1-cyclopropyl-N-ethyl-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-amine
CID 113289267
N-(2-cyclopentyl-3-imidazo[2,1-b][1,3]thiazol-6-ylpropyl)-2-methylpropan-1-amine
CID 115926891
[1-(2,2-dimethylcyclohexyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethyl]hydrazine
CID 107194550
4-cyclopentyl-1-imidazo[2,1-b][1,3]thiazol-6-yl-N-propylbutan-2-amine
CID 105023529
(4-cyclohexyl-1-imidazo[2,1-b][1,3]thiazol-6-ylbutan-2-yl)hydrazine
CID 105328743
3-cyclopropyl-1-imidazo[2,1-b][1,3]thiazol-6-ylbutan-2-ol
CID 115828299
N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-9-methyl-9-azabicyclo[3.3.1]nonan-3-amine
CID 115331691

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethylcyclohexyl)-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylethanamine?
The IUPAC name of 1-(3-ethylcyclohexyl)-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylethanamine (CID 115333760) is 1-(3-ethylcyclohexyl)-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylethanamine.
What is the SMILES notation for 1-(3-ethylcyclohexyl)-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylethanamine?
The canonical SMILES for 1-(3-ethylcyclohexyl)-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylethanamine is CCC1CCCC(C(Cc2cn3ccsc3n2)NC)C1.
What is the InChIKey of 1-(3-ethylcyclohexyl)-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylethanamine?
The InChIKey is LLQRRDAIMQDZQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3S/c1-3-12-5-4-6-13(9-12)15(17-2)10-14-11-19-7-8-20-16(19)18-14/h7-8,11-13,15,17H,3-6,9-10H2,1-2H3.
What are the key properties of 1-(3-ethylcyclohexyl)-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylethanamine?
1-(3-ethylcyclohexyl)-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylethanamine has a molecular weight of 291.46 g/mol, XLogP of 3.74, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethylcyclohexyl)-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylethanamine is sourced from PubChem (CID 115333760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).