4-ethyl-2-methyl-5-(4-propan-2-ylphenyl)-1,3-thiazole

C15H19NS — CID 70862177

IUPAC4-ethyl-2-methyl-5-(4-propan-2-ylphenyl)-1,3-thiazole
SMILESCCc1nc(C)sc1-c1ccc(C(C)C)cc1
InChIInChI=1S/C15H19NS/c1-5-14-15(17-11(4)16-14)13-8-6-12(7-9-13)10(2)3/h6-10H,5H2,1-4H3
InChIKeyZUTXDXRZGHPMJH-UHFFFAOYSA-N
MW245.39 g/mol
LogP4.80
Rot. Bonds3

About 4-ethyl-2-methyl-5-(4-propan-2-ylphenyl)-1,3-thiazole

4-ethyl-2-methyl-5-(4-propan-2-ylphenyl)-1,3-thiazole (PubChem CID 70862177) has the molecular formula C15H19NS and a molecular weight of 245.39 g/mol. Its IUPAC name is 4-ethyl-2-methyl-5-(4-propan-2-ylphenyl)-1,3-thiazole.

Molecular Properties

Compound Name4-ethyl-2-methyl-5-(4-propan-2-ylphenyl)-1,3-thiazole
PubChem CID70862177
Molecular FormulaC15H19NS
Molecular Weight245.39 g/mol
Exact Mass245.12
IUPAC Name4-ethyl-2-methyl-5-(4-propan-2-ylphenyl)-1,3-thiazole
SMILESCCc1nc(C)sc1-c1ccc(C(C)C)cc1
InChIInChI=1S/C15H19NS/c1-5-14-15(17-11(4)16-14)13-8-6-12(7-9-13)10(2)3/h6-10H,5H2,1-4H3
InChIKeyZUTXDXRZGHPMJH-UHFFFAOYSA-N
XLogP4.80
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.39
LogP ≤ 54.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2-methyl-5-(4-propan-2-ylphenyl)-1,3-thiazole?
The IUPAC name of 4-ethyl-2-methyl-5-(4-propan-2-ylphenyl)-1,3-thiazole (CID 70862177) is 4-ethyl-2-methyl-5-(4-propan-2-ylphenyl)-1,3-thiazole.
What is the SMILES notation for 4-ethyl-2-methyl-5-(4-propan-2-ylphenyl)-1,3-thiazole?
The canonical SMILES for 4-ethyl-2-methyl-5-(4-propan-2-ylphenyl)-1,3-thiazole is CCc1nc(C)sc1-c1ccc(C(C)C)cc1.
What is the InChIKey of 4-ethyl-2-methyl-5-(4-propan-2-ylphenyl)-1,3-thiazole?
The InChIKey is ZUTXDXRZGHPMJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NS/c1-5-14-15(17-11(4)16-14)13-8-6-12(7-9-13)10(2)3/h6-10H,5H2,1-4H3.
What are the key properties of 4-ethyl-2-methyl-5-(4-propan-2-ylphenyl)-1,3-thiazole?
4-ethyl-2-methyl-5-(4-propan-2-ylphenyl)-1,3-thiazole has a molecular weight of 245.39 g/mol, XLogP of 4.80, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-methyl-5-(4-propan-2-ylphenyl)-1,3-thiazole is sourced from PubChem (CID 70862177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).