2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]propan-1-ol

C11H13NO2S — CID 115089095

IUPAC2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]propan-1-ol
SMILESCc1ccc(-c2nc(C(C)CO)cs2)o1
InChIInChI=1S/C11H13NO2S/c1-7(5-13)9-6-15-11(12-9)10-4-3-8(2)14-10/h3-4,6-7,13H,5H2,1-2H3
InChIKeyYLQZDUXPDMYPID-UHFFFAOYSA-N
MW223.30 g/mol
LogP2.81
Rot. Bonds3

About 2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]propan-1-ol

2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]propan-1-ol (PubChem CID 115089095) has the molecular formula C11H13NO2S and a molecular weight of 223.30 g/mol. Its IUPAC name is 2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]propan-1-ol.

Molecular Properties

Compound Name2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]propan-1-ol
PubChem CID115089095
Molecular FormulaC11H13NO2S
Molecular Weight223.30 g/mol
Exact Mass223.07
IUPAC Name2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]propan-1-ol
SMILESCc1ccc(-c2nc(C(C)CO)cs2)o1
InChIInChI=1S/C11H13NO2S/c1-7(5-13)9-6-15-11(12-9)10-4-3-8(2)14-10/h3-4,6-7,13H,5H2,1-2H3
InChIKeyYLQZDUXPDMYPID-UHFFFAOYSA-N
XLogP2.81
TPSA46.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.30
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]butan-1-amine
CID 116891347
N-(1-hydroxypropan-2-yl)-N-methyl-2-(5-methylfuran-2-yl)-1,3-thiazole-4-carboxamide
CID 109388495
2-(2-thiophen-2-yl-1,3-thiazol-4-yl)propan-1-ol
CID 115089100
2-[2-(5-bromofuran-2-yl)-1,3-thiazol-4-yl]propan-1-amine
CID 115089098
2-[2-(2-chlorophenyl)-1,3-thiazol-4-yl]propan-1-ol
CID 115089512
2-[2-(5-chlorothiophen-2-yl)-1,3-thiazol-4-yl]propan-1-ol
CID 115089104
2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]acetic acid
CID 28819374
2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]ethanethiol
CID 116889582
[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]hydrazine
CID 116892150
2-[[2-(5-methylfuran-2-yl)-1,3-thiazole-4-carbonyl]-propan-2-ylamino]acetic acid
CID 119198555
2-methyl-3-[methyl-[[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]methyl]amino]propanenitrile
CID 47395660
(2R)-1-[N-[[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]methyl]anilino]propan-2-ol
CID 52537591

Frequently Asked Questions

What is the IUPAC name of 2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]propan-1-ol?
The IUPAC name of 2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]propan-1-ol (CID 115089095) is 2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]propan-1-ol.
What is the SMILES notation for 2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]propan-1-ol?
The canonical SMILES for 2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]propan-1-ol is Cc1ccc(-c2nc(C(C)CO)cs2)o1.
What is the InChIKey of 2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]propan-1-ol?
The InChIKey is YLQZDUXPDMYPID-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO2S/c1-7(5-13)9-6-15-11(12-9)10-4-3-8(2)14-10/h3-4,6-7,13H,5H2,1-2H3.
What are the key properties of 2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]propan-1-ol?
2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]propan-1-ol has a molecular weight of 223.30 g/mol, XLogP of 2.81, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]propan-1-ol is sourced from PubChem (CID 115089095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).