1-[4-ethyl-2-(4-ethylpiperazin-1-yl)-1,3-thiazol-5-yl]ethanamine

C13H24N4S — CID 82431056

IUPAC1-[4-ethyl-2-(4-ethylpiperazin-1-yl)-1,3-thiazol-5-yl]ethanamine
SMILESCCc1nc(N2CCN(CC)CC2)sc1C(C)N
InChIInChI=1S/C13H24N4S/c1-4-11-12(10(3)14)18-13(15-11)17-8-6-16(5-2)7-9-17/h10H,4-9,14H2,1-3H3
InChIKeyUYWVWHPJONWBLG-UHFFFAOYSA-N
MW268.43 g/mol
LogP1.87
Rot. Bonds4

About 1-[4-ethyl-2-(4-ethylpiperazin-1-yl)-1,3-thiazol-5-yl]ethanamine

1-[4-ethyl-2-(4-ethylpiperazin-1-yl)-1,3-thiazol-5-yl]ethanamine (PubChem CID 82431056) has the molecular formula C13H24N4S and a molecular weight of 268.43 g/mol. Its IUPAC name is 1-[4-ethyl-2-(4-ethylpiperazin-1-yl)-1,3-thiazol-5-yl]ethanamine.

Molecular Properties

Compound Name1-[4-ethyl-2-(4-ethylpiperazin-1-yl)-1,3-thiazol-5-yl]ethanamine
PubChem CID82431056
Molecular FormulaC13H24N4S
Molecular Weight268.43 g/mol
Exact Mass268.17
IUPAC Name1-[4-ethyl-2-(4-ethylpiperazin-1-yl)-1,3-thiazol-5-yl]ethanamine
SMILESCCc1nc(N2CCN(CC)CC2)sc1C(C)N
InChIInChI=1S/C13H24N4S/c1-4-11-12(10(3)14)18-13(15-11)17-8-6-16(5-2)7-9-17/h10H,4-9,14H2,1-3H3
InChIKeyUYWVWHPJONWBLG-UHFFFAOYSA-N
XLogP1.87
TPSA45.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.43
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[4-tert-butyl-2-(4-ethylpiperazin-1-yl)-1,3-thiazol-5-yl]ethanamine
CID 82439728
[4-ethyl-2-[4-(2-methylpropyl)piperazin-1-yl]-1,3-thiazol-5-yl]methanamine
CID 62777571
N-ethyl-1-[2-(4-ethylpiperazin-1-yl)-4-methyl-1,3-thiazol-5-yl]ethanamine
CID 55113434
N-[[4-ethyl-2-(4-ethylpiperazin-1-yl)-1,3-thiazol-5-yl]methyl]-2-methylpropan-2-amine
CID 62763950
1-(2,4-diethyl-1,3-thiazol-5-yl)ethanamine
CID 82428207
1-[2-[2-(azepan-1-yl)ethyl]-4-ethyl-1,3-thiazol-5-yl]ethanamine
CID 82430846
1-[4-methyl-2-(4-methylpiperazin-1-yl)-1,3-thiazol-5-yl]ethanamine
CID 62751339
1-[4-ethyl-2-(2-morpholin-4-ylethyl)-1,3-thiazol-5-yl]ethanamine
CID 82430826
N-[[2-(4-ethylpiperazin-1-yl)-4-propyl-1,3-thiazol-5-yl]methyl]ethanamine
CID 62764109
[2-(4-ethylpiperazin-1-yl)-4-(methoxymethyl)-1,3-thiazol-5-yl]methanethiol
CID 82441933
[4-tert-butyl-2-(4-ethylpiperazin-1-yl)-1,3-thiazol-5-yl]methanamine
CID 62764111
2-[2-(4-ethylpiperazin-1-yl)-4-methyl-1,3-thiazol-5-yl]propan-2-ol
CID 82427967

Frequently Asked Questions

What is the IUPAC name of 1-[4-ethyl-2-(4-ethylpiperazin-1-yl)-1,3-thiazol-5-yl]ethanamine?
The IUPAC name of 1-[4-ethyl-2-(4-ethylpiperazin-1-yl)-1,3-thiazol-5-yl]ethanamine (CID 82431056) is 1-[4-ethyl-2-(4-ethylpiperazin-1-yl)-1,3-thiazol-5-yl]ethanamine.
What is the SMILES notation for 1-[4-ethyl-2-(4-ethylpiperazin-1-yl)-1,3-thiazol-5-yl]ethanamine?
The canonical SMILES for 1-[4-ethyl-2-(4-ethylpiperazin-1-yl)-1,3-thiazol-5-yl]ethanamine is CCc1nc(N2CCN(CC)CC2)sc1C(C)N.
What is the InChIKey of 1-[4-ethyl-2-(4-ethylpiperazin-1-yl)-1,3-thiazol-5-yl]ethanamine?
The InChIKey is UYWVWHPJONWBLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4S/c1-4-11-12(10(3)14)18-13(15-11)17-8-6-16(5-2)7-9-17/h10H,4-9,14H2,1-3H3.
What are the key properties of 1-[4-ethyl-2-(4-ethylpiperazin-1-yl)-1,3-thiazol-5-yl]ethanamine?
1-[4-ethyl-2-(4-ethylpiperazin-1-yl)-1,3-thiazol-5-yl]ethanamine has a molecular weight of 268.43 g/mol, XLogP of 1.87, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-ethyl-2-(4-ethylpiperazin-1-yl)-1,3-thiazol-5-yl]ethanamine is sourced from PubChem (CID 82431056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).