2-(2-ethoxyphenyl)-4-propan-2-yl-1,3-thiazole

C14H17NOS — CID 112690146

IUPAC2-(2-ethoxyphenyl)-4-propan-2-yl-1,3-thiazole
SMILESCCOc1ccccc1-c1nc(C(C)C)cs1
InChIInChI=1S/C14H17NOS/c1-4-16-13-8-6-5-7-11(13)14-15-12(9-17-14)10(2)3/h5-10H,4H2,1-3H3
InChIKeyMOGRZQQIKBWEIN-UHFFFAOYSA-N
MW247.36 g/mol
LogP4.33
Rot. Bonds4

About 2-(2-ethoxyphenyl)-4-propan-2-yl-1,3-thiazole

2-(2-ethoxyphenyl)-4-propan-2-yl-1,3-thiazole (PubChem CID 112690146) has the molecular formula C14H17NOS and a molecular weight of 247.36 g/mol. Its IUPAC name is 2-(2-ethoxyphenyl)-4-propan-2-yl-1,3-thiazole.

Molecular Properties

Compound Name2-(2-ethoxyphenyl)-4-propan-2-yl-1,3-thiazole
PubChem CID112690146
Molecular FormulaC14H17NOS
Molecular Weight247.36 g/mol
Exact Mass247.10
IUPAC Name2-(2-ethoxyphenyl)-4-propan-2-yl-1,3-thiazole
SMILESCCOc1ccccc1-c1nc(C(C)C)cs1
InChIInChI=1S/C14H17NOS/c1-4-16-13-8-6-5-7-11(13)14-15-12(9-17-14)10(2)3/h5-10H,4H2,1-3H3
InChIKeyMOGRZQQIKBWEIN-UHFFFAOYSA-N
XLogP4.33
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.36
LogP ≤ 54.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-butan-2-yl-2-(2-methoxyphenyl)-1,3-thiazole
CID 113253756
2-[2-(2-ethoxyphenyl)-1,3-thiazol-4-yl]propan-2-amine
CID 82516097
2-ethoxy-5-(4-propan-2-yl-1,3-thiazol-2-yl)aniline
CID 82152397
2-(2-ethoxyphenyl)-1,3-thiazole-4-carboxylic acid
CID 43140171
2-[2-(2-ethoxyphenyl)-1,3-thiazol-4-yl]-N-(3-methylbutan-2-yl)acetamide
CID 43039088
4-chloro-2-(2-ethoxyphenyl)-6-propan-2-ylpyrimidine
CID 43557749
2-[2-(2-ethoxyphenyl)-1,3-thiazol-4-yl]-N-[1-(2-methoxyphenyl)ethyl]acetamide
CID 16596855
ethyl 3-[2-(2-ethoxyphenyl)-1,3-thiazol-4-yl]propanoate
CID 103485086
2-[2-(2-ethoxyphenyl)-1,3-thiazol-4-yl]-N-(6-methylheptan-2-yl)acetamide
CID 55486396
N-[1-(3,4-diethoxyphenyl)ethyl]-2-[2-(2-ethoxyphenyl)-1,3-thiazol-4-yl]acetamide
CID 46418276
3-[4-(2-ethoxyphenyl)-1,3-thiazol-2-yl]aniline
CID 43667895
2-[2-(2-ethoxyphenyl)-1,3-thiazol-4-yl]-N-(1,3-thiazol-2-yl)acetamide
CID 16590476

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethoxyphenyl)-4-propan-2-yl-1,3-thiazole?
The IUPAC name of 2-(2-ethoxyphenyl)-4-propan-2-yl-1,3-thiazole (CID 112690146) is 2-(2-ethoxyphenyl)-4-propan-2-yl-1,3-thiazole.
What is the SMILES notation for 2-(2-ethoxyphenyl)-4-propan-2-yl-1,3-thiazole?
The canonical SMILES for 2-(2-ethoxyphenyl)-4-propan-2-yl-1,3-thiazole is CCOc1ccccc1-c1nc(C(C)C)cs1.
What is the InChIKey of 2-(2-ethoxyphenyl)-4-propan-2-yl-1,3-thiazole?
The InChIKey is MOGRZQQIKBWEIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NOS/c1-4-16-13-8-6-5-7-11(13)14-15-12(9-17-14)10(2)3/h5-10H,4H2,1-3H3.
What are the key properties of 2-(2-ethoxyphenyl)-4-propan-2-yl-1,3-thiazole?
2-(2-ethoxyphenyl)-4-propan-2-yl-1,3-thiazole has a molecular weight of 247.36 g/mol, XLogP of 4.33, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethoxyphenyl)-4-propan-2-yl-1,3-thiazole is sourced from PubChem (CID 112690146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).