4-ethyl-2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)cyclohexan-1-amine

C14H21N3S — CID 115332381

IUPAC4-ethyl-2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)cyclohexan-1-amine
SMILESCCC1CCC(N)C(Cc2cn3ccsc3n2)C1
InChIInChI=1S/C14H21N3S/c1-2-10-3-4-13(15)11(7-10)8-12-9-17-5-6-18-14(17)16-12/h5-6,9-11,13H,2-4,7-8,15H2,1H3
InChIKeyVBGPTAOPIIJIDL-UHFFFAOYSA-N
MW263.41 g/mol
LogP3.09
Rot. Bonds3

About 4-ethyl-2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)cyclohexan-1-amine

4-ethyl-2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)cyclohexan-1-amine (PubChem CID 115332381) has the molecular formula C14H21N3S and a molecular weight of 263.41 g/mol. Its IUPAC name is 4-ethyl-2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)cyclohexan-1-amine.

Molecular Properties

Compound Name4-ethyl-2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)cyclohexan-1-amine
PubChem CID115332381
Molecular FormulaC14H21N3S
Molecular Weight263.41 g/mol
Exact Mass263.15
IUPAC Name4-ethyl-2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)cyclohexan-1-amine
SMILESCCC1CCC(N)C(Cc2cn3ccsc3n2)C1
InChIInChI=1S/C14H21N3S/c1-2-10-3-4-13(15)11(7-10)8-12-9-17-5-6-18-14(17)16-12/h5-6,9-11,13H,2-4,7-8,15H2,1H3
InChIKeyVBGPTAOPIIJIDL-UHFFFAOYSA-N
XLogP3.09
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.41
LogP ≤ 53.09
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-ylethanone
CID 113289131
[1-(3-ethylcyclopentyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethyl]hydrazine
CID 105233423
6-[(2-chloro-5-methylcyclohexyl)methyl]imidazo[2,1-b][1,3]thiazole
CID 115334149
N-ethyl-1-(3-ethylcyclopentyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine
CID 115333767
6-[(3-chlorocycloheptyl)methyl]imidazo[2,1-b][1,3]thiazole
CID 115334773
6-[(2-bromo-5-tert-butylcyclohexyl)methyl]imidazo[2,1-b][1,3]thiazole
CID 115334166
N-[[2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)cyclopentyl]methyl]propan-1-amine
CID 115335393
4-fluoro-4-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)cyclohexan-1-amine
CID 112562533
1-(3-ethylcyclohexyl)-2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylethanamine
CID 115333760
3-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-2-methyl-N-propylcyclopentan-1-amine
CID 115334747
1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)azetidin-3-amine
CID 115332589
[3-ethyl-1-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)cyclohexyl]methanamine
CID 115335047

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)cyclohexan-1-amine?
The IUPAC name of 4-ethyl-2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)cyclohexan-1-amine (CID 115332381) is 4-ethyl-2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)cyclohexan-1-amine.
What is the SMILES notation for 4-ethyl-2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)cyclohexan-1-amine?
The canonical SMILES for 4-ethyl-2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)cyclohexan-1-amine is CCC1CCC(N)C(Cc2cn3ccsc3n2)C1.
What is the InChIKey of 4-ethyl-2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)cyclohexan-1-amine?
The InChIKey is VBGPTAOPIIJIDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3S/c1-2-10-3-4-13(15)11(7-10)8-12-9-17-5-6-18-14(17)16-12/h5-6,9-11,13H,2-4,7-8,15H2,1H3.
What are the key properties of 4-ethyl-2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)cyclohexan-1-amine?
4-ethyl-2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)cyclohexan-1-amine has a molecular weight of 263.41 g/mol, XLogP of 3.09, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)cyclohexan-1-amine is sourced from PubChem (CID 115332381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).