1-[2-(imidazo[2,1-b][1,3]thiazol-6-ylmethoxy)phenyl]propan-1-ol

C15H16N2O2S — CID 115332159

IUPAC1-[2-(imidazo[2,1-b][1,3]thiazol-6-ylmethoxy)phenyl]propan-1-ol
SMILESCCC(O)c1ccccc1OCc1cn2ccsc2n1
InChIInChI=1S/C15H16N2O2S/c1-2-13(18)12-5-3-4-6-14(12)19-10-11-9-17-7-8-20-15(17)16-11/h3-9,13,18H,2,10H2,1H3
InChIKeyUSWPMKUXRYKPFS-UHFFFAOYSA-N
MW288.37 g/mol
LogP3.42
Rot. Bonds5

About 1-[2-(imidazo[2,1-b][1,3]thiazol-6-ylmethoxy)phenyl]propan-1-ol

1-[2-(imidazo[2,1-b][1,3]thiazol-6-ylmethoxy)phenyl]propan-1-ol (PubChem CID 115332159) has the molecular formula C15H16N2O2S and a molecular weight of 288.37 g/mol. Its IUPAC name is 1-[2-(imidazo[2,1-b][1,3]thiazol-6-ylmethoxy)phenyl]propan-1-ol.

Molecular Properties

Compound Name1-[2-(imidazo[2,1-b][1,3]thiazol-6-ylmethoxy)phenyl]propan-1-ol
PubChem CID115332159
Molecular FormulaC15H16N2O2S
Molecular Weight288.37 g/mol
Exact Mass288.09
IUPAC Name1-[2-(imidazo[2,1-b][1,3]thiazol-6-ylmethoxy)phenyl]propan-1-ol
SMILESCCC(O)c1ccccc1OCc1cn2ccsc2n1
InChIInChI=1S/C15H16N2O2S/c1-2-13(18)12-5-3-4-6-14(12)19-10-11-9-17-7-8-20-15(17)16-11/h3-9,13,18H,2,10H2,1H3
InChIKeyUSWPMKUXRYKPFS-UHFFFAOYSA-N
XLogP3.42
TPSA46.76 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.37
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(imidazo[2,1-b][1,3]thiazol-6-ylmethoxy)phenyl]propan-1-ol?
The IUPAC name of 1-[2-(imidazo[2,1-b][1,3]thiazol-6-ylmethoxy)phenyl]propan-1-ol (CID 115332159) is 1-[2-(imidazo[2,1-b][1,3]thiazol-6-ylmethoxy)phenyl]propan-1-ol.
What is the SMILES notation for 1-[2-(imidazo[2,1-b][1,3]thiazol-6-ylmethoxy)phenyl]propan-1-ol?
The canonical SMILES for 1-[2-(imidazo[2,1-b][1,3]thiazol-6-ylmethoxy)phenyl]propan-1-ol is CCC(O)c1ccccc1OCc1cn2ccsc2n1.
What is the InChIKey of 1-[2-(imidazo[2,1-b][1,3]thiazol-6-ylmethoxy)phenyl]propan-1-ol?
The InChIKey is USWPMKUXRYKPFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2S/c1-2-13(18)12-5-3-4-6-14(12)19-10-11-9-17-7-8-20-15(17)16-11/h3-9,13,18H,2,10H2,1H3.
What are the key properties of 1-[2-(imidazo[2,1-b][1,3]thiazol-6-ylmethoxy)phenyl]propan-1-ol?
1-[2-(imidazo[2,1-b][1,3]thiazol-6-ylmethoxy)phenyl]propan-1-ol has a molecular weight of 288.37 g/mol, XLogP of 3.42, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(imidazo[2,1-b][1,3]thiazol-6-ylmethoxy)phenyl]propan-1-ol is sourced from PubChem (CID 115332159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).