2-[3-(3-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]ethanol

C14H14N2O2S — CID 94698491

IUPAC2-[3-(3-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]ethanol
SMILESCOc1cccc(-c2c(CCO)sc3nccn23)c1
InChIInChI=1S/C14H14N2O2S/c1-18-11-4-2-3-10(9-11)13-12(5-8-17)19-14-15-6-7-16(13)14/h2-4,6-7,9,17H,5,8H2,1H3
InChIKeyRQVSEYJWFQVXBZ-UHFFFAOYSA-N
MW274.35 g/mol
LogP2.61
Rot. Bonds4

About 2-[3-(3-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]ethanol

2-[3-(3-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]ethanol (PubChem CID 94698491) has the molecular formula C14H14N2O2S and a molecular weight of 274.35 g/mol. Its IUPAC name is 2-[3-(3-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]ethanol.

Molecular Properties

Compound Name2-[3-(3-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]ethanol
PubChem CID94698491
Molecular FormulaC14H14N2O2S
Molecular Weight274.35 g/mol
Exact Mass274.08
IUPAC Name2-[3-(3-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]ethanol
SMILESCOc1cccc(-c2c(CCO)sc3nccn23)c1
InChIInChI=1S/C14H14N2O2S/c1-18-11-4-2-3-10(9-11)13-12(5-8-17)19-14-15-6-7-16(13)14/h2-4,6-7,9,17H,5,8H2,1H3
InChIKeyRQVSEYJWFQVXBZ-UHFFFAOYSA-N
XLogP2.61
TPSA46.76 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.35
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[3-(3-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]ethanol?
The IUPAC name of 2-[3-(3-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]ethanol (CID 94698491) is 2-[3-(3-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]ethanol.
What is the SMILES notation for 2-[3-(3-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]ethanol?
The canonical SMILES for 2-[3-(3-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]ethanol is COc1cccc(-c2c(CCO)sc3nccn23)c1.
What is the InChIKey of 2-[3-(3-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]ethanol?
The InChIKey is RQVSEYJWFQVXBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2S/c1-18-11-4-2-3-10(9-11)13-12(5-8-17)19-14-15-6-7-16(13)14/h2-4,6-7,9,17H,5,8H2,1H3.
What are the key properties of 2-[3-(3-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]ethanol?
2-[3-(3-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]ethanol has a molecular weight of 274.35 g/mol, XLogP of 2.61, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(3-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]ethanol is sourced from PubChem (CID 94698491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).