[6-(2-methylbutylsulfanyl)imidazo[2,1-b][1,3]thiazol-5-yl]methanol

C11H16N2OS2 — CID 107762201

IUPAC[6-(2-methylbutylsulfanyl)imidazo[2,1-b][1,3]thiazol-5-yl]methanol
SMILESCCC(C)CSc1nc2sccn2c1CO
InChIInChI=1S/C11H16N2OS2/c1-3-8(2)7-16-10-9(6-14)13-4-5-15-11(13)12-10/h4-5,8,14H,3,6-7H2,1-2H3
InChIKeyPWIQSRKXMCBFKX-UHFFFAOYSA-N
MW256.40 g/mol
LogP3.03
Rot. Bonds5

About [6-(2-methylbutylsulfanyl)imidazo[2,1-b][1,3]thiazol-5-yl]methanol

[6-(2-methylbutylsulfanyl)imidazo[2,1-b][1,3]thiazol-5-yl]methanol (PubChem CID 107762201) has the molecular formula C11H16N2OS2 and a molecular weight of 256.40 g/mol. Its IUPAC name is [6-(2-methylbutylsulfanyl)imidazo[2,1-b][1,3]thiazol-5-yl]methanol.

Molecular Properties

Compound Name[6-(2-methylbutylsulfanyl)imidazo[2,1-b][1,3]thiazol-5-yl]methanol
PubChem CID107762201
Molecular FormulaC11H16N2OS2
Molecular Weight256.40 g/mol
Exact Mass256.07
IUPAC Name[6-(2-methylbutylsulfanyl)imidazo[2,1-b][1,3]thiazol-5-yl]methanol
SMILESCCC(C)CSc1nc2sccn2c1CO
InChIInChI=1S/C11H16N2OS2/c1-3-8(2)7-16-10-9(6-14)13-4-5-15-11(13)12-10/h4-5,8,14H,3,6-7H2,1-2H3
InChIKeyPWIQSRKXMCBFKX-UHFFFAOYSA-N
XLogP3.03
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.40
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(6-tert-butylsulfanylimidazo[2,1-b][1,3]thiazol-5-yl)methanol
CID 63813355
[6-[methyl(2-methylbutyl)amino]imidazo[2,1-b][1,3]thiazol-5-yl]methanol
CID 43476005
2-[[5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-6-yl]-methylamino]propan-1-ol
CID 104552635
(6-propylsulfanylimidazo[2,1-b][1,3]thiazol-5-yl)methanamine
CID 39194776
N-[(6-propan-2-ylsulfanylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine
CID 63808415
[6-(2-chlorophenyl)sulfanylimidazo[2,1-b][1,3]thiazol-5-yl]methanol
CID 55239467
N-[(6-methylsulfanylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine
CID 63813892
[6-[bis(3-methylbutyl)amino]imidazo[2,1-b][1,3]thiazol-5-yl]methanol
CID 107870420
[6-[methyl(3-methylbutyl)amino]imidazo[2,1-b][1,3]thiazol-5-yl]methanol
CID 61428785
3-[5-(propylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]sulfanylpropan-1-ol
CID 66127925
3-[5-(methylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-yl]sulfanylpropan-1-ol
CID 66128131
[6-[methyl(3-methylbutan-2-yl)amino]imidazo[2,1-b][1,3]thiazol-5-yl]methanol
CID 43570324

Frequently Asked Questions

What is the IUPAC name of [6-(2-methylbutylsulfanyl)imidazo[2,1-b][1,3]thiazol-5-yl]methanol?
The IUPAC name of [6-(2-methylbutylsulfanyl)imidazo[2,1-b][1,3]thiazol-5-yl]methanol (CID 107762201) is [6-(2-methylbutylsulfanyl)imidazo[2,1-b][1,3]thiazol-5-yl]methanol.
What is the SMILES notation for [6-(2-methylbutylsulfanyl)imidazo[2,1-b][1,3]thiazol-5-yl]methanol?
The canonical SMILES for [6-(2-methylbutylsulfanyl)imidazo[2,1-b][1,3]thiazol-5-yl]methanol is CCC(C)CSc1nc2sccn2c1CO.
What is the InChIKey of [6-(2-methylbutylsulfanyl)imidazo[2,1-b][1,3]thiazol-5-yl]methanol?
The InChIKey is PWIQSRKXMCBFKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2OS2/c1-3-8(2)7-16-10-9(6-14)13-4-5-15-11(13)12-10/h4-5,8,14H,3,6-7H2,1-2H3.
What are the key properties of [6-(2-methylbutylsulfanyl)imidazo[2,1-b][1,3]thiazol-5-yl]methanol?
[6-(2-methylbutylsulfanyl)imidazo[2,1-b][1,3]thiazol-5-yl]methanol has a molecular weight of 256.40 g/mol, XLogP of 3.03, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(2-methylbutylsulfanyl)imidazo[2,1-b][1,3]thiazol-5-yl]methanol is sourced from PubChem (CID 107762201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).