4-[2-(2-ethyl-5-propylpiperazin-1-yl)ethyl]-2-methyl-1,3-thiazole

C15H27N3S — CID 106043590

IUPAC4-[2-(2-ethyl-5-propylpiperazin-1-yl)ethyl]-2-methyl-1,3-thiazole
SMILESCCCC1CN(CCc2csc(C)n2)C(CC)CN1
InChIInChI=1S/C15H27N3S/c1-4-6-13-10-18(15(5-2)9-16-13)8-7-14-11-19-12(3)17-14/h11,13,15-16H,4-10H2,1-3H3
InChIKeyYUDAYLZAZSKGGG-UHFFFAOYSA-N
MW281.47 g/mol
LogP2.85
Rot. Bonds6

About 4-[2-(2-ethyl-5-propylpiperazin-1-yl)ethyl]-2-methyl-1,3-thiazole

4-[2-(2-ethyl-5-propylpiperazin-1-yl)ethyl]-2-methyl-1,3-thiazole (PubChem CID 106043590) has the molecular formula C15H27N3S and a molecular weight of 281.47 g/mol. Its IUPAC name is 4-[2-(2-ethyl-5-propylpiperazin-1-yl)ethyl]-2-methyl-1,3-thiazole.

Molecular Properties

Compound Name4-[2-(2-ethyl-5-propylpiperazin-1-yl)ethyl]-2-methyl-1,3-thiazole
PubChem CID106043590
Molecular FormulaC15H27N3S
Molecular Weight281.47 g/mol
Exact Mass281.19
IUPAC Name4-[2-(2-ethyl-5-propylpiperazin-1-yl)ethyl]-2-methyl-1,3-thiazole
SMILESCCCC1CN(CCc2csc(C)n2)C(CC)CN1
InChIInChI=1S/C15H27N3S/c1-4-6-13-10-18(15(5-2)9-16-13)8-7-14-11-19-12(3)17-14/h11,13,15-16H,4-10H2,1-3H3
InChIKeyYUDAYLZAZSKGGG-UHFFFAOYSA-N
XLogP2.85
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.47
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[2-(2-ethyl-5-propylpiperazin-1-yl)ethyl]-5-methyl-1,2,4-oxadiazole
CID 106421459
5-[2-(2-ethyl-5-propylpiperazin-1-yl)ethyl]-3-methyl-1,2,4-oxadiazole
CID 106421628
4-[2-(2,5-dimethylpiperazin-1-yl)ethyl]-2-methyl-1,3-thiazole
CID 106043580
4-[(2-ethyl-5-propylpiperazin-1-yl)methyl]-2-methylpyrimidine
CID 64945783
2-[(2-ethyl-5-propylpiperazin-1-yl)methyl]-5-methylpyrazine
CID 64941741
4-[2-[2,5-di(propan-2-yl)piperazin-1-yl]ethyl]-2-methyl-1,3-thiazole
CID 106043362
1-(2-ethoxyethyl)-2-ethyl-5-propylpiperazine
CID 64846765
2,5-diethyl-1-(2-pyridin-2-ylethyl)piperazine
CID 64933750
2-ethyl-1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-5-propylpiperazine
CID 82884970
2-[2-(5-tert-butyl-2-ethylpiperazin-1-yl)ethyl]-4-methyl-1,3-thiazole
CID 64941766
4-[(2,5-diethylpiperazin-1-yl)methyl]-2-propan-2-yl-1,3-thiazole
CID 64978673
2-ethyl-1-methyl-5-propylpiperazine
CID 64846947

Frequently Asked Questions

What is the IUPAC name of 4-[2-(2-ethyl-5-propylpiperazin-1-yl)ethyl]-2-methyl-1,3-thiazole?
The IUPAC name of 4-[2-(2-ethyl-5-propylpiperazin-1-yl)ethyl]-2-methyl-1,3-thiazole (CID 106043590) is 4-[2-(2-ethyl-5-propylpiperazin-1-yl)ethyl]-2-methyl-1,3-thiazole.
What is the SMILES notation for 4-[2-(2-ethyl-5-propylpiperazin-1-yl)ethyl]-2-methyl-1,3-thiazole?
The canonical SMILES for 4-[2-(2-ethyl-5-propylpiperazin-1-yl)ethyl]-2-methyl-1,3-thiazole is CCCC1CN(CCc2csc(C)n2)C(CC)CN1.
What is the InChIKey of 4-[2-(2-ethyl-5-propylpiperazin-1-yl)ethyl]-2-methyl-1,3-thiazole?
The InChIKey is YUDAYLZAZSKGGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3S/c1-4-6-13-10-18(15(5-2)9-16-13)8-7-14-11-19-12(3)17-14/h11,13,15-16H,4-10H2,1-3H3.
What are the key properties of 4-[2-(2-ethyl-5-propylpiperazin-1-yl)ethyl]-2-methyl-1,3-thiazole?
4-[2-(2-ethyl-5-propylpiperazin-1-yl)ethyl]-2-methyl-1,3-thiazole has a molecular weight of 281.47 g/mol, XLogP of 2.85, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(2-ethyl-5-propylpiperazin-1-yl)ethyl]-2-methyl-1,3-thiazole is sourced from PubChem (CID 106043590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).