2-(4-ethylpiperazin-1-yl)-4-phenyl-1,3-thiazole

C15H19N3S — CID 102103813

IUPAC2-(4-ethylpiperazin-1-yl)-4-phenyl-1,3-thiazole
SMILESCCN1CCN(c2nc(-c3ccccc3)cs2)CC1
InChIInChI=1S/C15H19N3S/c1-2-17-8-10-18(11-9-17)15-16-14(12-19-15)13-6-4-3-5-7-13/h3-7,12H,2,8-11H2,1H3
InChIKeyFSFQTEZQLASBSO-UHFFFAOYSA-N
MW273.40 g/mol
LogP2.95
Rot. Bonds3

About 2-(4-ethylpiperazin-1-yl)-4-phenyl-1,3-thiazole

2-(4-ethylpiperazin-1-yl)-4-phenyl-1,3-thiazole (PubChem CID 102103813) has the molecular formula C15H19N3S and a molecular weight of 273.40 g/mol. Its IUPAC name is 2-(4-ethylpiperazin-1-yl)-4-phenyl-1,3-thiazole.

Molecular Properties

Compound Name2-(4-ethylpiperazin-1-yl)-4-phenyl-1,3-thiazole
PubChem CID102103813
Molecular FormulaC15H19N3S
Molecular Weight273.40 g/mol
Exact Mass273.13
IUPAC Name2-(4-ethylpiperazin-1-yl)-4-phenyl-1,3-thiazole
SMILESCCN1CCN(c2nc(-c3ccccc3)cs2)CC1
InChIInChI=1S/C15H19N3S/c1-2-17-8-10-18(11-9-17)15-16-14(12-19-15)13-6-4-3-5-7-13/h3-7,12H,2,8-11H2,1H3
InChIKeyFSFQTEZQLASBSO-UHFFFAOYSA-N
XLogP2.95
TPSA19.37 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.40
LogP ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-phenyl-2-[4-(4-phenyl-1,3-thiazol-2-yl)piperazin-1-yl]-1,3-thiazole
CID 14573306
2-[4-(4-phenyl-1,3-thiazol-2-yl)piperazin-1-yl]ethanamine
CID 82167588
2-[4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]-4-phenyl-1,3-thiazole
CID 1447329
2-[(4-ethyl-1,4-diazepan-1-yl)methyl]-4-phenyl-1,3-thiazole;methane
CID 158416700
4-phenyl-2-(4-prop-1-en-2-ylpiperazin-1-yl)-1,3-thiazole
CID 163418785
2-[4-(4-methoxyphenyl)piperazin-1-yl]-4-phenyl-1,3-thiazole
CID 1477904
4-[2-(4-ethylpiperazin-1-yl)-1,3-thiazol-4-yl]benzene-1,3-diol
CID 122668603
4-(4-phenyl-1,3-thiazol-2-yl)-N,N-dipropylpiperazine-1-carboxamide
CID 57199831
3-[[4-(4-phenyl-1,3-thiazol-2-yl)piperazin-1-yl]methyl]benzonitrile
CID 50964149
ethyl 4-[2-[4-(4-phenyl-1,3-thiazol-2-yl)piperazin-1-yl]ethoxy]benzoate
CID 142759916
3-ethyl-5-[1-[4-(4-phenyl-1,3-thiazol-2-yl)piperazin-1-yl]ethyl]-1,2,4-oxadiazole
CID 133372388
5-[2-(4-ethylpiperazin-1-yl)-1,3-thiazol-4-yl]-N-methyl-1,3,4-thiadiazol-2-amine
CID 82514892

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethylpiperazin-1-yl)-4-phenyl-1,3-thiazole?
The IUPAC name of 2-(4-ethylpiperazin-1-yl)-4-phenyl-1,3-thiazole (CID 102103813) is 2-(4-ethylpiperazin-1-yl)-4-phenyl-1,3-thiazole.
What is the SMILES notation for 2-(4-ethylpiperazin-1-yl)-4-phenyl-1,3-thiazole?
The canonical SMILES for 2-(4-ethylpiperazin-1-yl)-4-phenyl-1,3-thiazole is CCN1CCN(c2nc(-c3ccccc3)cs2)CC1.
What is the InChIKey of 2-(4-ethylpiperazin-1-yl)-4-phenyl-1,3-thiazole?
The InChIKey is FSFQTEZQLASBSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3S/c1-2-17-8-10-18(11-9-17)15-16-14(12-19-15)13-6-4-3-5-7-13/h3-7,12H,2,8-11H2,1H3.
What are the key properties of 2-(4-ethylpiperazin-1-yl)-4-phenyl-1,3-thiazole?
2-(4-ethylpiperazin-1-yl)-4-phenyl-1,3-thiazole has a molecular weight of 273.40 g/mol, XLogP of 2.95, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethylpiperazin-1-yl)-4-phenyl-1,3-thiazole is sourced from PubChem (CID 102103813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).