N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]octan-4-amine

C15H25N3OS — CID 106023556

IUPACN-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]octan-4-amine
SMILESCCCCC(CCC)NCc1c(OC)nc2sccn12
InChIInChI=1S/C15H25N3OS/c1-4-6-8-12(7-5-2)16-11-13-14(19-3)17-15-18(13)9-10-20-15/h9-10,12,16H,4-8,11H2,1-3H3
InChIKeyLCNYXUPSIRPDFD-UHFFFAOYSA-N
MW295.45 g/mol
LogP3.85
Rot. Bonds9

About N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]octan-4-amine

N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]octan-4-amine (PubChem CID 106023556) has the molecular formula C15H25N3OS and a molecular weight of 295.45 g/mol. Its IUPAC name is N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]octan-4-amine.

Molecular Properties

Compound NameN-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]octan-4-amine
PubChem CID106023556
Molecular FormulaC15H25N3OS
Molecular Weight295.45 g/mol
Exact Mass295.17
IUPAC NameN-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]octan-4-amine
SMILESCCCCC(CCC)NCc1c(OC)nc2sccn12
InChIInChI=1S/C15H25N3OS/c1-4-6-8-12(7-5-2)16-11-13-14(19-3)17-15-18(13)9-10-20-15/h9-10,12,16H,4-8,11H2,1-3H3
InChIKeyLCNYXUPSIRPDFD-UHFFFAOYSA-N
XLogP3.85
TPSA38.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.45
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]octan-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-methoxy-2-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]propan-1-ol
CID 106187628
2-N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-N,1-N-dimethylpropane-1,2-diamine
CID 82946403
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]morpholin-4-amine
CID 83010121
(1R)-1-cyclohexyl-N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine
CID 81385166
4-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]-3-methylbutan-1-ol
CID 66090379
1-(2-bromophenyl)-N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine
CID 43780223
3-methoxy-N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]propan-1-amine
CID 43769566
(1S)-N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(3-methylphenyl)ethanamine
CID 81369770
1-(2-ethylphenyl)-N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]methanamine
CID 64681770
3,3,3-trifluoro-N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]propan-1-amine
CID 63226560
N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]cyclooctanamine
CID 43760152

Frequently Asked Questions

What is the IUPAC name of N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]octan-4-amine?
The IUPAC name of N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]octan-4-amine (CID 106023556) is N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]octan-4-amine.
What is the SMILES notation for N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]octan-4-amine?
The canonical SMILES for N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]octan-4-amine is CCCCC(CCC)NCc1c(OC)nc2sccn12.
What is the InChIKey of N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]octan-4-amine?
The InChIKey is LCNYXUPSIRPDFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3OS/c1-4-6-8-12(7-5-2)16-11-13-14(19-3)17-15-18(13)9-10-20-15/h9-10,12,16H,4-8,11H2,1-3H3.
What are the key properties of N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]octan-4-amine?
N-[(6-methoxyimidazo[2,1-b][1,3]thiazol-5-yl)methyl]octan-4-amine has a molecular weight of 295.45 g/mol, XLogP of 3.85, 9 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]octan-4-amine is sourced from PubChem (CID 106023556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).