2-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]-1-phenylethanol

C16H19N3OS — CID 43625895

IUPAC2-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]-1-phenylethanol
SMILESCc1cn2c(CNCC(O)c3ccccc3)c(C)nc2s1
InChIInChI=1S/C16H19N3OS/c1-11-10-19-14(12(2)18-16(19)21-11)8-17-9-15(20)13-6-4-3-5-7-13/h3-7,10,15,17,20H,8-9H2,1-2H3
InChIKeyFEDFUBLYBUESBC-UHFFFAOYSA-N
MW301.42 g/mol
LogP2.84
Rot. Bonds5

About 2-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]-1-phenylethanol

2-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]-1-phenylethanol (PubChem CID 43625895) has the molecular formula C16H19N3OS and a molecular weight of 301.42 g/mol. Its IUPAC name is 2-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]-1-phenylethanol.

Molecular Properties

Compound Name2-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]-1-phenylethanol
PubChem CID43625895
Molecular FormulaC16H19N3OS
Molecular Weight301.42 g/mol
Exact Mass301.12
IUPAC Name2-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]-1-phenylethanol
SMILESCc1cn2c(CNCC(O)c3ccccc3)c(C)nc2s1
InChIInChI=1S/C16H19N3OS/c1-11-10-19-14(12(2)18-16(19)21-11)8-17-9-15(20)13-6-4-3-5-7-13/h3-7,10,15,17,20H,8-9H2,1-2H3
InChIKeyFEDFUBLYBUESBC-UHFFFAOYSA-N
XLogP2.84
TPSA49.56 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.42
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 2-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]acetate
CID 43625703
N-[2-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]ethyl]-2-methylpropanamide
CID 43625807
N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-(3-methylphenyl)methanamine
CID 43625818
(1R)-1-(2-chlorophenyl)-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine
CID 81374703
1-(2-chlorophenyl)-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine
CID 43625803
6-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]hexan-1-ol
CID 103924077
N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-1-pyridazin-3-ylmethanamine
CID 106834011
4-[2-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]ethyl]phenol
CID 61238024
N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-2-methoxyethanamine
CID 43625696
N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]-N',N'-di(propan-2-yl)ethane-1,2-diamine
CID 43625709
1-(2,5-difluorophenyl)-N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]methanamine
CID 63379683
N-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]hexan-1-amine
CID 43625829

Frequently Asked Questions

What is the IUPAC name of 2-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]-1-phenylethanol?
The IUPAC name of 2-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]-1-phenylethanol (CID 43625895) is 2-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]-1-phenylethanol.
What is the SMILES notation for 2-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]-1-phenylethanol?
The canonical SMILES for 2-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]-1-phenylethanol is Cc1cn2c(CNCC(O)c3ccccc3)c(C)nc2s1.
What is the InChIKey of 2-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]-1-phenylethanol?
The InChIKey is FEDFUBLYBUESBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3OS/c1-11-10-19-14(12(2)18-16(19)21-11)8-17-9-15(20)13-6-4-3-5-7-13/h3-7,10,15,17,20H,8-9H2,1-2H3.
What are the key properties of 2-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]-1-phenylethanol?
2-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]-1-phenylethanol has a molecular weight of 301.42 g/mol, XLogP of 2.84, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methylamino]-1-phenylethanol is sourced from PubChem (CID 43625895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).