2-(4-ethyl-3-pyridinyl)-4-(4-methylphenyl)-1,3-thiazole

C17H16N2S — CID 86217272

IUPAC2-(4-ethyl-3-pyridinyl)-4-(4-methylphenyl)-1,3-thiazole
SMILESCCc1ccncc1-c1nc(-c2ccc(C)cc2)cs1
InChIInChI=1S/C17H16N2S/c1-3-13-8-9-18-10-15(13)17-19-16(11-20-17)14-6-4-12(2)5-7-14/h4-11H,3H2,1-2H3
InChIKeyIHGFUJHPGCAZNV-UHFFFAOYSA-N
MW280.40 g/mol
LogP4.74
Rot. Bonds3

About 2-(4-ethyl-3-pyridinyl)-4-(4-methylphenyl)-1,3-thiazole

2-(4-ethyl-3-pyridinyl)-4-(4-methylphenyl)-1,3-thiazole (PubChem CID 86217272) has the molecular formula C17H16N2S and a molecular weight of 280.40 g/mol. Its IUPAC name is 2-(4-ethyl-3-pyridinyl)-4-(4-methylphenyl)-1,3-thiazole.

Molecular Properties

Compound Name2-(4-ethyl-3-pyridinyl)-4-(4-methylphenyl)-1,3-thiazole
PubChem CID86217272
Molecular FormulaC17H16N2S
Molecular Weight280.40 g/mol
Exact Mass280.10
IUPAC Name2-(4-ethyl-3-pyridinyl)-4-(4-methylphenyl)-1,3-thiazole
SMILESCCc1ccncc1-c1nc(-c2ccc(C)cc2)cs1
InChIInChI=1S/C17H16N2S/c1-3-13-8-9-18-10-15(13)17-19-16(11-20-17)14-6-4-12(2)5-7-14/h4-11H,3H2,1-2H3
InChIKeyIHGFUJHPGCAZNV-UHFFFAOYSA-N
XLogP4.74
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.40
LogP ≤ 54.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-(4-ethyl-3-pyridinyl)-4-(4-methylphenyl)-1,3-thiazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(3-bromophenyl)-2-(4-ethyl-3-pyridinyl)-1,3-thiazole
CID 91360116
4-(4-methylphenyl)-2-(4-phenyl-3-pyridinyl)-1,3-thiazole
CID 90735429
2-(4-cyclopentyl-3-pyridinyl)-4-(4-methylphenyl)-1,3-thiazole
CID 91570843
4-[2-[4-(ethylaminomethyl)-3-pyridinyl]-1,3-thiazol-4-yl]benzonitrile
CID 154070935
3-[4-(4-ethyl-3-pyridinyl)-1,3-thiazol-2-yl]benzenesulfonamide
CID 22049774
4-[2-(4-methyl-3-pyridinyl)-1,3-thiazol-4-yl]benzamide
CID 22049680
4-(2-fluorophenyl)-2-(4-propyl-3-pyridinyl)-1,3-thiazole
CID 90958489
4-(4-ethylphenyl)-2-pyridin-3-yl-1,3-thiazole
CID 849786
4-(4-methyl-3-pyridinyl)-2-pyridin-4-yl-1,3-thiazole
CID 22049802
2-[3-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-4-pyridinyl]propan-2-ol
CID 22049722
2-(4-methoxyphenyl)-4-(4-methyl-3-pyridinyl)-1,3-thiazole
CID 91135598
N-(3,5-dimethylphenyl)-2-[4-(2-pyridin-4-yl-1,3-thiazol-4-yl)phenyl]acetamide
CID 100597321

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethyl-3-pyridinyl)-4-(4-methylphenyl)-1,3-thiazole?
The IUPAC name of 2-(4-ethyl-3-pyridinyl)-4-(4-methylphenyl)-1,3-thiazole (CID 86217272) is 2-(4-ethyl-3-pyridinyl)-4-(4-methylphenyl)-1,3-thiazole.
What is the SMILES notation for 2-(4-ethyl-3-pyridinyl)-4-(4-methylphenyl)-1,3-thiazole?
The canonical SMILES for 2-(4-ethyl-3-pyridinyl)-4-(4-methylphenyl)-1,3-thiazole is CCc1ccncc1-c1nc(-c2ccc(C)cc2)cs1.
What is the InChIKey of 2-(4-ethyl-3-pyridinyl)-4-(4-methylphenyl)-1,3-thiazole?
The InChIKey is IHGFUJHPGCAZNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2S/c1-3-13-8-9-18-10-15(13)17-19-16(11-20-17)14-6-4-12(2)5-7-14/h4-11H,3H2,1-2H3.
What are the key properties of 2-(4-ethyl-3-pyridinyl)-4-(4-methylphenyl)-1,3-thiazole?
2-(4-ethyl-3-pyridinyl)-4-(4-methylphenyl)-1,3-thiazole has a molecular weight of 280.40 g/mol, XLogP of 4.74, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethyl-3-pyridinyl)-4-(4-methylphenyl)-1,3-thiazole is sourced from PubChem (CID 86217272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).