4-(4-ethylphenyl)-2-pyridin-3-yl-1,3-thiazole

C16H14N2S — CID 849786

IUPAC4-(4-ethylphenyl)-2-pyridin-3-yl-1,3-thiazole
SMILESCCc1ccc(-c2csc(-c3cccnc3)n2)cc1
InChIInChI=1S/C16H14N2S/c1-2-12-5-7-13(8-6-12)15-11-19-16(18-15)14-4-3-9-17-10-14/h3-11H,2H2,1H3
InChIKeyRRFBLZQGRMOKLQ-UHFFFAOYSA-N
MW266.37 g/mol
LogP4.43
Rot. Bonds3

About 4-(4-ethylphenyl)-2-pyridin-3-yl-1,3-thiazole

4-(4-ethylphenyl)-2-pyridin-3-yl-1,3-thiazole (PubChem CID 849786) has the molecular formula C16H14N2S and a molecular weight of 266.37 g/mol. Its IUPAC name is 4-(4-ethylphenyl)-2-pyridin-3-yl-1,3-thiazole.

Molecular Properties

Compound Name4-(4-ethylphenyl)-2-pyridin-3-yl-1,3-thiazole
PubChem CID849786
Molecular FormulaC16H14N2S
Molecular Weight266.37 g/mol
Exact Mass266.09
IUPAC Name4-(4-ethylphenyl)-2-pyridin-3-yl-1,3-thiazole
SMILESCCc1ccc(-c2csc(-c3cccnc3)n2)cc1
InChIInChI=1S/C16H14N2S/c1-2-12-5-7-13(8-6-12)15-11-19-16(18-15)14-4-3-9-17-10-14/h3-11H,2H2,1H3
InChIKeyRRFBLZQGRMOKLQ-UHFFFAOYSA-N
XLogP4.43
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.37
LogP ≤ 54.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-(4-fluorophenyl)-2-pyridin-3-yl-1,3-thiazole
CID 592589
N-methyl-4-(4-pyridin-3-yl-1,3-thiazol-2-yl)aniline
CID 116965446
2-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]aniline
CID 60707173
[3-(2-pyridin-3-yl-1,3-thiazol-4-yl)phenyl]methanamine
CID 63152435
methyl 4-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzoate;hydrobromide
CID 18613847
4-(3,4-difluorophenyl)-2-pyridin-3-yl-1,3-thiazole
CID 2800024
4-pyridin-2-yl-2-pyridin-3-yl-1,3-thiazole
CID 119088487
4-(4-methoxy-3-methylphenyl)-2-pyridin-3-yl-1,3-thiazole
CID 885223
1-ethyl-3-[3-(2-pyridin-3-yl-1,3-thiazol-4-yl)phenyl]thiourea
CID 108784263
(1R)-1-(6-chloro-3-pyridinyl)-2-[2-[4-(2-pyridin-3-yl-1,3-thiazol-4-yl)phenyl]ethylamino]ethanol
CID 87975327
4-(4-ethylphenyl)-2-methyl-1,3-thiazole
CID 19240269
4-(1H-pyrazol-5-yl)-2-pyridin-3-yl-1,3-thiazole
CID 141340133

Frequently Asked Questions

What is the IUPAC name of 4-(4-ethylphenyl)-2-pyridin-3-yl-1,3-thiazole?
The IUPAC name of 4-(4-ethylphenyl)-2-pyridin-3-yl-1,3-thiazole (CID 849786) is 4-(4-ethylphenyl)-2-pyridin-3-yl-1,3-thiazole.
What is the SMILES notation for 4-(4-ethylphenyl)-2-pyridin-3-yl-1,3-thiazole?
The canonical SMILES for 4-(4-ethylphenyl)-2-pyridin-3-yl-1,3-thiazole is CCc1ccc(-c2csc(-c3cccnc3)n2)cc1.
What is the InChIKey of 4-(4-ethylphenyl)-2-pyridin-3-yl-1,3-thiazole?
The InChIKey is RRFBLZQGRMOKLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2S/c1-2-12-5-7-13(8-6-12)15-11-19-16(18-15)14-4-3-9-17-10-14/h3-11H,2H2,1H3.
What are the key properties of 4-(4-ethylphenyl)-2-pyridin-3-yl-1,3-thiazole?
4-(4-ethylphenyl)-2-pyridin-3-yl-1,3-thiazole has a molecular weight of 266.37 g/mol, XLogP of 4.43, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-ethylphenyl)-2-pyridin-3-yl-1,3-thiazole is sourced from PubChem (CID 849786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).