2-ethyl-5-phenyl-4-pyridin-3-yl-1,3-thiazole

C16H14N2S — CID 22993797

IUPAC2-ethyl-5-phenyl-4-pyridin-3-yl-1,3-thiazole
SMILESCCc1nc(-c2cccnc2)c(-c2ccccc2)s1
InChIInChI=1S/C16H14N2S/c1-2-14-18-15(13-9-6-10-17-11-13)16(19-14)12-7-4-3-5-8-12/h3-11H,2H2,1H3
InChIKeyMXZSZCUSTBDIKJ-UHFFFAOYSA-N
MW266.37 g/mol
LogP4.43
Rot. Bonds3

About 2-ethyl-5-phenyl-4-pyridin-3-yl-1,3-thiazole

2-ethyl-5-phenyl-4-pyridin-3-yl-1,3-thiazole (PubChem CID 22993797) has the molecular formula C16H14N2S and a molecular weight of 266.37 g/mol. Its IUPAC name is 2-ethyl-5-phenyl-4-pyridin-3-yl-1,3-thiazole.

Molecular Properties

Compound Name2-ethyl-5-phenyl-4-pyridin-3-yl-1,3-thiazole
PubChem CID22993797
Molecular FormulaC16H14N2S
Molecular Weight266.37 g/mol
Exact Mass266.09
IUPAC Name2-ethyl-5-phenyl-4-pyridin-3-yl-1,3-thiazole
SMILESCCc1nc(-c2cccnc2)c(-c2ccccc2)s1
InChIInChI=1S/C16H14N2S/c1-2-14-18-15(13-9-6-10-17-11-13)16(19-14)12-7-4-3-5-8-12/h3-11H,2H2,1H3
InChIKeyMXZSZCUSTBDIKJ-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

[5-(3-fluorophenyl)-4-pyridin-3-yl-1,3-thiazol-2-yl]methanamine
CID 82106836
N-[(4,5-diphenyl-1,3-thiazol-2-yl)methyl]ethanamine
CID 62543017
2-[2-methyl-4-[[5-(4-phenylphenyl)-4-pyridin-3-yl-1,3-thiazol-2-yl]methoxy]phenoxy]acetic acid
CID 58956141
(5-methyl-4-pyridin-3-yl-1,3-thiazol-2-yl)methanamine
CID 82106363
N-[(4,5-diphenyl-1,3-thiazol-2-yl)methyl]propan-2-amine
CID 154194483
2-[2-(dimethylamino)ethyl]-4-pyridin-3-yl-1,3-thiazole-5-carboxylic acid
CID 82227655
N-[(5-phenyl-2-pyridin-3-yl-1,3-thiazol-4-yl)methyl]ethanamine
CID 64717713
N-ethyl-N-methyl-4-phenyl-2-pyridin-3-yl-1,3-thiazol-5-amine
CID 126635045
2-[[butyl(ethyl)amino]methyl]-4-pyridin-3-yl-1,3-thiazole-5-carboxylic acid
CID 94971044
2-(4-methyl-5-pyridin-3-yl-1,3-thiazol-2-yl)ethanamine
CID 39244014
5-(2-chloro-4-pyridinyl)-2-ethyl-4-(3-methylphenyl)-1,3-thiazole
CID 11674063
2-[2-methyl-4-[[4-pyridin-3-yl-5-[4-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]methoxy]phenoxy]acetic acid
CID 58956027

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-5-phenyl-4-pyridin-3-yl-1,3-thiazole?
The IUPAC name of 2-ethyl-5-phenyl-4-pyridin-3-yl-1,3-thiazole (CID 22993797) is 2-ethyl-5-phenyl-4-pyridin-3-yl-1,3-thiazole.
What is the SMILES notation for 2-ethyl-5-phenyl-4-pyridin-3-yl-1,3-thiazole?
The canonical SMILES for 2-ethyl-5-phenyl-4-pyridin-3-yl-1,3-thiazole is CCc1nc(-c2cccnc2)c(-c2ccccc2)s1.
What is the InChIKey of 2-ethyl-5-phenyl-4-pyridin-3-yl-1,3-thiazole?
The InChIKey is MXZSZCUSTBDIKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2S/c1-2-14-18-15(13-9-6-10-17-11-13)16(19-14)12-7-4-3-5-8-12/h3-11H,2H2,1H3.
What are the key properties of 2-ethyl-5-phenyl-4-pyridin-3-yl-1,3-thiazole?
2-ethyl-5-phenyl-4-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 2-ethyl-5-phenyl-4-pyridin-3-yl-1,3-thiazole is sourced from PubChem (CID 22993797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).