N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]cyclooctanamine

C15H23N3OS — CID 43760152

IUPACN-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]cyclooctanamine
SMILESCOc1nc2sccn2c1CNC1CCCCCCC1
InChIInChI=1S/C15H23N3OS/c1-19-14-13(18-9-10-20-15(18)17-14)11-16-12-7-5-3-2-4-6-8-12/h9-10,12,16H,2-8,11H2,1H3
InChIKeyXXILWTLDDATHCF-UHFFFAOYSA-N
MW293.44 g/mol
LogP3.61
Rot. Bonds4

About N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]cyclooctanamine

N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]cyclooctanamine (PubChem CID 43760152) has the molecular formula C15H23N3OS and a molecular weight of 293.44 g/mol. Its IUPAC name is N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]cyclooctanamine.

Molecular Properties

Compound NameN-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]cyclooctanamine
PubChem CID43760152
Molecular FormulaC15H23N3OS
Molecular Weight293.44 g/mol
Exact Mass293.16
IUPAC NameN-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]cyclooctanamine
SMILESCOc1nc2sccn2c1CNC1CCCCCCC1
InChIInChI=1S/C15H23N3OS/c1-19-14-13(18-9-10-20-15(18)17-14)11-16-12-7-5-3-2-4-6-8-12/h9-10,12,16H,2-8,11H2,1H3
InChIKeyXXILWTLDDATHCF-UHFFFAOYSA-N
XLogP3.61
TPSA38.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.44
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]cyclohexan-1-ol
CID 43792297
2-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]cyclohexan-1-ol
CID 55064027
N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-3,5-dimethylcyclohexan-1-amine
CID 64734020
(1R)-1-cyclohexyl-N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine
CID 81385166
5-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]-1-methylpiperidin-2-one
CID 64654906
1-(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)-N-(2-methylpropoxy)methanamine
CID 82709719
N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(thiolan-3-yl)methanamine
CID 107295391
N-(cyclopentylmethyl)-5-[(cyclopropylamino)methyl]-N-methylimidazo[2,1-b][1,3]thiazol-6-amine
CID 63631094
3-methoxy-N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]propan-1-amine
CID 43769566
N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]morpholin-4-amine
CID 83010121
3-(2-methoxyethoxy)-N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]propan-1-amine
CID 43770890
3-methoxy-2-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]propan-1-ol
CID 106187628

Frequently Asked Questions

What is the IUPAC name of N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]cyclooctanamine?
The IUPAC name of N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]cyclooctanamine (CID 43760152) is N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]cyclooctanamine.
What is the SMILES notation for N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]cyclooctanamine?
The canonical SMILES for N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]cyclooctanamine is COc1nc2sccn2c1CNC1CCCCCCC1.
What is the InChIKey of N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]cyclooctanamine?
The InChIKey is XXILWTLDDATHCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3OS/c1-19-14-13(18-9-10-20-15(18)17-14)11-16-12-7-5-3-2-4-6-8-12/h9-10,12,16H,2-8,11H2,1H3.
What are the key properties of N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]cyclooctanamine?
N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]cyclooctanamine has a molecular weight of 293.44 g/mol, XLogP of 3.61, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]cyclooctanamine is sourced from PubChem (CID 43760152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).