[6-[methyl(pyridin-3-ylmethyl)amino]imidazo[2,1-b][1,3]thiazol-5-yl]methanol

C13H14N4OS — CID 43563571

IUPAC[6-[methyl(pyridin-3-ylmethyl)amino]imidazo[2,1-b][1,3]thiazol-5-yl]methanol
SMILESCN(Cc1cccnc1)c1nc2sccn2c1CO
InChIInChI=1S/C13H14N4OS/c1-16(8-10-3-2-4-14-7-10)12-11(9-18)17-5-6-19-13(17)15-12/h2-7,18H,8-9H2,1H3
InChIKeyPVCMLAOVLJKDIX-UHFFFAOYSA-N
MW274.35 g/mol
LogP1.92
Rot. Bonds4

About [6-[methyl(pyridin-3-ylmethyl)amino]imidazo[2,1-b][1,3]thiazol-5-yl]methanol

[6-[methyl(pyridin-3-ylmethyl)amino]imidazo[2,1-b][1,3]thiazol-5-yl]methanol (PubChem CID 43563571) has the molecular formula C13H14N4OS and a molecular weight of 274.35 g/mol. Its IUPAC name is [6-[methyl(pyridin-3-ylmethyl)amino]imidazo[2,1-b][1,3]thiazol-5-yl]methanol.

Molecular Properties

Compound Name[6-[methyl(pyridin-3-ylmethyl)amino]imidazo[2,1-b][1,3]thiazol-5-yl]methanol
PubChem CID43563571
Molecular FormulaC13H14N4OS
Molecular Weight274.35 g/mol
Exact Mass274.09
IUPAC Name[6-[methyl(pyridin-3-ylmethyl)amino]imidazo[2,1-b][1,3]thiazol-5-yl]methanol
SMILESCN(Cc1cccnc1)c1nc2sccn2c1CO
InChIInChI=1S/C13H14N4OS/c1-16(8-10-3-2-4-14-7-10)12-11(9-18)17-5-6-19-13(17)15-12/h2-7,18H,8-9H2,1H3
InChIKeyPVCMLAOVLJKDIX-UHFFFAOYSA-N
XLogP1.92
TPSA53.66 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.35
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-(2-aminopropyl)-N-methyl-N-(pyridin-3-ylmethyl)imidazo[2,1-b][1,3]thiazol-6-amine
CID 63786996
5-(aminomethyl)-N-methyl-N-(pyridin-4-ylmethyl)imidazo[2,1-b][1,3]thiazol-6-amine
CID 43564433
[2-[methyl(pyridin-3-ylmethyl)amino]-3-pyridinyl]methanol
CID 61255832
6-chloro-N-methyl-N-(pyridin-3-ylmethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 60813639
[6-[methyl(3-methylbutan-2-yl)amino]imidazo[2,1-b][1,3]thiazol-5-yl]methanol
CID 43570324
2-[[5-(hydroxymethyl)imidazo[2,1-b][1,3]thiazol-6-yl]-methylamino]propan-1-ol
CID 104552635
N-[(3-chlorophenyl)methyl]-N-methyl-5-(methylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-amine
CID 61416879
N-[(3-bromophenyl)methyl]-N-methyl-5-(methylaminomethyl)imidazo[2,1-b][1,3]thiazol-6-amine
CID 61415968
5-(chloromethyl)-N-[(4-methoxyphenyl)methyl]-N-methylimidazo[2,1-b][1,3]thiazol-6-amine
CID 61418071
5-(aminomethyl)-N-methyl-N-(thiophen-3-ylmethyl)imidazo[2,1-b][1,3]thiazol-6-amine
CID 43528430
5-(bromomethyl)-N-[(2-bromophenyl)methyl]-N-methylimidazo[2,1-b][1,3]thiazol-6-amine
CID 107081020
[6-[methyl(1-thiophen-2-ylpropan-2-yl)amino]imidazo[2,1-b][1,3]thiazol-5-yl]methanol
CID 79486099

Frequently Asked Questions

What is the IUPAC name of [6-[methyl(pyridin-3-ylmethyl)amino]imidazo[2,1-b][1,3]thiazol-5-yl]methanol?
The IUPAC name of [6-[methyl(pyridin-3-ylmethyl)amino]imidazo[2,1-b][1,3]thiazol-5-yl]methanol (CID 43563571) is [6-[methyl(pyridin-3-ylmethyl)amino]imidazo[2,1-b][1,3]thiazol-5-yl]methanol.
What is the SMILES notation for [6-[methyl(pyridin-3-ylmethyl)amino]imidazo[2,1-b][1,3]thiazol-5-yl]methanol?
The canonical SMILES for [6-[methyl(pyridin-3-ylmethyl)amino]imidazo[2,1-b][1,3]thiazol-5-yl]methanol is CN(Cc1cccnc1)c1nc2sccn2c1CO.
What is the InChIKey of [6-[methyl(pyridin-3-ylmethyl)amino]imidazo[2,1-b][1,3]thiazol-5-yl]methanol?
The InChIKey is PVCMLAOVLJKDIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4OS/c1-16(8-10-3-2-4-14-7-10)12-11(9-18)17-5-6-19-13(17)15-12/h2-7,18H,8-9H2,1H3.
What are the key properties of [6-[methyl(pyridin-3-ylmethyl)amino]imidazo[2,1-b][1,3]thiazol-5-yl]methanol?
[6-[methyl(pyridin-3-ylmethyl)amino]imidazo[2,1-b][1,3]thiazol-5-yl]methanol has a molecular weight of 274.35 g/mol, XLogP of 1.92, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[methyl(pyridin-3-ylmethyl)amino]imidazo[2,1-b][1,3]thiazol-5-yl]methanol is sourced from PubChem (CID 43563571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).