2-[6-(4-ethyl-1,3-thiazol-2-yl)-2-pyridinyl]propan-2-ol

C13H16N2OS — CID 121308355

IUPAC2-[6-(4-ethyl-1,3-thiazol-2-yl)-2-pyridinyl]propan-2-ol
SMILESCCc1csc(-c2cccc(C(C)(C)O)n2)n1
InChIInChI=1S/C13H16N2OS/c1-4-9-8-17-12(14-9)10-6-5-7-11(15-10)13(2,3)16/h5-8,16H,4H2,1-3H3
InChIKeyAJYOKCODOUIQMC-UHFFFAOYSA-N
MW248.35 g/mol
LogP2.99
Rot. Bonds3

About 2-[6-(4-ethyl-1,3-thiazol-2-yl)-2-pyridinyl]propan-2-ol

2-[6-(4-ethyl-1,3-thiazol-2-yl)-2-pyridinyl]propan-2-ol (PubChem CID 121308355) has the molecular formula C13H16N2OS and a molecular weight of 248.35 g/mol. Its IUPAC name is 2-[6-(4-ethyl-1,3-thiazol-2-yl)-2-pyridinyl]propan-2-ol.

Molecular Properties

Compound Name2-[6-(4-ethyl-1,3-thiazol-2-yl)-2-pyridinyl]propan-2-ol
PubChem CID121308355
Molecular FormulaC13H16N2OS
Molecular Weight248.35 g/mol
Exact Mass248.10
IUPAC Name2-[6-(4-ethyl-1,3-thiazol-2-yl)-2-pyridinyl]propan-2-ol
SMILESCCc1csc(-c2cccc(C(C)(C)O)n2)n1
InChIInChI=1S/C13H16N2OS/c1-4-9-8-17-12(14-9)10-6-5-7-11(15-10)13(2,3)16/h5-8,16H,4H2,1-3H3
InChIKeyAJYOKCODOUIQMC-UHFFFAOYSA-N
XLogP2.99
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.35
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-ethyl-2-phenyl-1,3-thiazole
CID 5324799
ethane;4-ethyl-2-phenyl-1,3-thiazole
CID 91427044
4-ethyl-2-phenyl-1,3-thiazole;dihydrochloride
CID 118514483
ethyl 3-[6-[4-(cyclobutylmethyl)-1,3-thiazol-2-yl]-2-pyridinyl]-2,2-dimethylpropanoate
CID 121301957
2-[6-[(3-ethyl-1H-1,2,4-triazol-5-yl)methyl]-2-pyridinyl]propan-2-ol
CID 166663056
2-[6-[(2-propyl-1,3-oxazol-5-yl)methyl]-2-pyridinyl]propan-2-ol
CID 154658132
2-[2-(6-methyl-2-pyridinyl)-1,3-thiazol-4-yl]acetonitrile
CID 63556167
6-[4-(hydroxymethyl)-1,3-thiazol-2-yl]pyridine-2-carboxylic acid
CID 121344488
2-[6-(2-aminoethyl)-2-pyridinyl]propan-2-ol
CID 155007002
4-(2,2-dimethylpropylsulfonylmethyl)-2-pyridin-2-yl-1,3-thiazole
CID 122140520
ethyl 2-[2-(6-methoxy-2-pyridinyl)-1,3-thiazol-4-yl]-2-methylpropanoate
CID 103347819
6-(2-hydroxypropan-2-yl)pyridine-2-carboxamide
CID 155437518

Frequently Asked Questions

What is the IUPAC name of 2-[6-(4-ethyl-1,3-thiazol-2-yl)-2-pyridinyl]propan-2-ol?
The IUPAC name of 2-[6-(4-ethyl-1,3-thiazol-2-yl)-2-pyridinyl]propan-2-ol (CID 121308355) is 2-[6-(4-ethyl-1,3-thiazol-2-yl)-2-pyridinyl]propan-2-ol.
What is the SMILES notation for 2-[6-(4-ethyl-1,3-thiazol-2-yl)-2-pyridinyl]propan-2-ol?
The canonical SMILES for 2-[6-(4-ethyl-1,3-thiazol-2-yl)-2-pyridinyl]propan-2-ol is CCc1csc(-c2cccc(C(C)(C)O)n2)n1.
What is the InChIKey of 2-[6-(4-ethyl-1,3-thiazol-2-yl)-2-pyridinyl]propan-2-ol?
The InChIKey is AJYOKCODOUIQMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2OS/c1-4-9-8-17-12(14-9)10-6-5-7-11(15-10)13(2,3)16/h5-8,16H,4H2,1-3H3.
What are the key properties of 2-[6-(4-ethyl-1,3-thiazol-2-yl)-2-pyridinyl]propan-2-ol?
2-[6-(4-ethyl-1,3-thiazol-2-yl)-2-pyridinyl]propan-2-ol has a molecular weight of 248.35 g/mol, XLogP of 2.99, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(4-ethyl-1,3-thiazol-2-yl)-2-pyridinyl]propan-2-ol is sourced from PubChem (CID 121308355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).