cyclohexyl-(2-pyridin-3-ylimidazo[5,1-b][1,3]thiazol-3-yl)methanol

C17H19N3OS — CID 151248149

IUPACcyclohexyl-(2-pyridin-3-ylimidazo[5,1-b][1,3]thiazol-3-yl)methanol
SMILESOC(c1c(-c2cccnc2)sc2cncn12)C1CCCCC1
InChIInChI=1S/C17H19N3OS/c21-16(12-5-2-1-3-6-12)15-17(13-7-4-8-18-9-13)22-14-10-19-11-20(14)15/h4,7-12,16,21H,1-3,5-6H2
InChIKeyNRSXRBWOTJJSBQ-UHFFFAOYSA-N
MW313.43 g/mol
LogP4.07
Rot. Bonds3

About cyclohexyl-(2-pyridin-3-ylimidazo[5,1-b][1,3]thiazol-3-yl)methanol

cyclohexyl-(2-pyridin-3-ylimidazo[5,1-b][1,3]thiazol-3-yl)methanol (PubChem CID 151248149) has the molecular formula C17H19N3OS and a molecular weight of 313.43 g/mol. Its IUPAC name is cyclohexyl-(2-pyridin-3-ylimidazo[5,1-b][1,3]thiazol-3-yl)methanol.

Molecular Properties

Compound Namecyclohexyl-(2-pyridin-3-ylimidazo[5,1-b][1,3]thiazol-3-yl)methanol
PubChem CID151248149
Molecular FormulaC17H19N3OS
Molecular Weight313.43 g/mol
Exact Mass313.12
IUPAC Namecyclohexyl-(2-pyridin-3-ylimidazo[5,1-b][1,3]thiazol-3-yl)methanol
SMILESOC(c1c(-c2cccnc2)sc2cncn12)C1CCCCC1
InChIInChI=1S/C17H19N3OS/c21-16(12-5-2-1-3-6-12)15-17(13-7-4-8-18-9-13)22-14-10-19-11-20(14)15/h4,7-12,16,21H,1-3,5-6H2
InChIKeyNRSXRBWOTJJSBQ-UHFFFAOYSA-N
XLogP4.07
TPSA50.42 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.43
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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US11267824, Example 181
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US11267824, Example 144
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US11267824, Example 159
CID 152650725
(4-Imidazo[2,1-b][1,3]benzothiazol-2-ylphenyl)methanol
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[5-(1-Phenylimidazo[1,5-a]pyridin-3-yl)thiophen-2-yl]methanol
CID 134142080
[3-(4-Bromophenyl)imidazo[2,1-b][1,3]thiazol-5-yl]-phenylmethanol
CID 155518507
[3-(4-Bromophenyl)imidazo[2,1-b][1,3]thiazol-5-yl]-cyclohexylmethanol
CID 155532803

Frequently Asked Questions

What is the IUPAC name of cyclohexyl-(2-pyridin-3-ylimidazo[5,1-b][1,3]thiazol-3-yl)methanol?
The IUPAC name of cyclohexyl-(2-pyridin-3-ylimidazo[5,1-b][1,3]thiazol-3-yl)methanol (CID 151248149) is cyclohexyl-(2-pyridin-3-ylimidazo[5,1-b][1,3]thiazol-3-yl)methanol.
What is the SMILES notation for cyclohexyl-(2-pyridin-3-ylimidazo[5,1-b][1,3]thiazol-3-yl)methanol?
The canonical SMILES for cyclohexyl-(2-pyridin-3-ylimidazo[5,1-b][1,3]thiazol-3-yl)methanol is OC(c1c(-c2cccnc2)sc2cncn12)C1CCCCC1.
What is the InChIKey of cyclohexyl-(2-pyridin-3-ylimidazo[5,1-b][1,3]thiazol-3-yl)methanol?
The InChIKey is NRSXRBWOTJJSBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3OS/c21-16(12-5-2-1-3-6-12)15-17(13-7-4-8-18-9-13)22-14-10-19-11-20(14)15/h4,7-12,16,21H,1-3,5-6H2.
What are the key properties of cyclohexyl-(2-pyridin-3-ylimidazo[5,1-b][1,3]thiazol-3-yl)methanol?
cyclohexyl-(2-pyridin-3-ylimidazo[5,1-b][1,3]thiazol-3-yl)methanol has a molecular weight of 313.43 g/mol, XLogP of 4.07, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl-(2-pyridin-3-ylimidazo[5,1-b][1,3]thiazol-3-yl)methanol is sourced from PubChem (CID 151248149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).