1-imidazo[2,1-b][1,3]thiazol-6-yl-5-methoxy-N-methylpentan-2-amine

C12H19N3OS — CID 113289221

IUPAC1-imidazo[2,1-b][1,3]thiazol-6-yl-5-methoxy-N-methylpentan-2-amine
SMILESCNC(CCCOC)Cc1cn2ccsc2n1
InChIInChI=1S/C12H19N3OS/c1-13-10(4-3-6-16-2)8-11-9-15-5-7-17-12(15)14-11/h5,7,9-10,13H,3-4,6,8H2,1-2H3
InChIKeyWLUQMVLZCNEAIH-UHFFFAOYSA-N
MW253.37 g/mol
LogP1.95
Rot. Bonds7

About 1-imidazo[2,1-b][1,3]thiazol-6-yl-5-methoxy-N-methylpentan-2-amine

1-imidazo[2,1-b][1,3]thiazol-6-yl-5-methoxy-N-methylpentan-2-amine (PubChem CID 113289221) has the molecular formula C12H19N3OS and a molecular weight of 253.37 g/mol. Its IUPAC name is 1-imidazo[2,1-b][1,3]thiazol-6-yl-5-methoxy-N-methylpentan-2-amine.

Molecular Properties

Compound Name1-imidazo[2,1-b][1,3]thiazol-6-yl-5-methoxy-N-methylpentan-2-amine
PubChem CID113289221
Molecular FormulaC12H19N3OS
Molecular Weight253.37 g/mol
Exact Mass253.12
IUPAC Name1-imidazo[2,1-b][1,3]thiazol-6-yl-5-methoxy-N-methylpentan-2-amine
SMILESCNC(CCCOC)Cc1cn2ccsc2n1
InChIInChI=1S/C12H19N3OS/c1-13-10(4-3-6-16-2)8-11-9-15-5-7-17-12(15)14-11/h5,7,9-10,13H,3-4,6,8H2,1-2H3
InChIKeyWLUQMVLZCNEAIH-UHFFFAOYSA-N
XLogP1.95
TPSA38.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.37
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 1-imidazo[2,1-b][1,3]thiazol-6-yl-5-methoxy-N-methylpentan-2-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

(1-imidazo[2,1-b][1,3]thiazol-6-yl-4-methoxybutan-2-yl)hydrazine
CID 105206256
3-imidazo[2,1-b][1,3]thiazol-6-yl-1-N,1-N,2-N-trimethylpropane-1,2-diamine
CID 115333859
1-imidazo[2,1-b][1,3]thiazol-6-yl-4-methoxybutan-2-amine
CID 115333521
4,4,4-trifluoro-1-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylbutan-2-amine
CID 113289195
1-imidazo[2,1-b][1,3]thiazol-6-yl-4-(2-methoxyethoxy)-N-propylbutan-2-amine
CID 102928656
1-(2,6-difluorophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylpropan-2-amine
CID 105023533
1-(2-bromophenyl)-3-imidazo[2,1-b][1,3]thiazol-6-yl-N-methylpropan-2-amine
CID 115333611
N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-1-methoxybutan-2-amine
CID 81333206
N,3-diethyl-1-imidazo[2,1-b][1,3]thiazol-6-yl-3-methoxypentan-2-amine
CID 116761301
2-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-N-(2-methoxyethyl)-4-methylpentan-1-amine
CID 115334364
methyl 2-hydroxy-3-imidazo[2,1-b][1,3]thiazol-6-ylpropanoate
CID 115332918
2-(imidazo[2,1-b][1,3]thiazol-6-ylmethylamino)-3-methoxypropan-1-ol
CID 106190367

Frequently Asked Questions

What is the IUPAC name of 1-imidazo[2,1-b][1,3]thiazol-6-yl-5-methoxy-N-methylpentan-2-amine?
The IUPAC name of 1-imidazo[2,1-b][1,3]thiazol-6-yl-5-methoxy-N-methylpentan-2-amine (CID 113289221) is 1-imidazo[2,1-b][1,3]thiazol-6-yl-5-methoxy-N-methylpentan-2-amine.
What is the SMILES notation for 1-imidazo[2,1-b][1,3]thiazol-6-yl-5-methoxy-N-methylpentan-2-amine?
The canonical SMILES for 1-imidazo[2,1-b][1,3]thiazol-6-yl-5-methoxy-N-methylpentan-2-amine is CNC(CCCOC)Cc1cn2ccsc2n1.
What is the InChIKey of 1-imidazo[2,1-b][1,3]thiazol-6-yl-5-methoxy-N-methylpentan-2-amine?
The InChIKey is WLUQMVLZCNEAIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3OS/c1-13-10(4-3-6-16-2)8-11-9-15-5-7-17-12(15)14-11/h5,7,9-10,13H,3-4,6,8H2,1-2H3.
What are the key properties of 1-imidazo[2,1-b][1,3]thiazol-6-yl-5-methoxy-N-methylpentan-2-amine?
1-imidazo[2,1-b][1,3]thiazol-6-yl-5-methoxy-N-methylpentan-2-amine has a molecular weight of 253.37 g/mol, XLogP of 1.95, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-imidazo[2,1-b][1,3]thiazol-6-yl-5-methoxy-N-methylpentan-2-amine is sourced from PubChem (CID 113289221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).