1-(1-propylpiperidin-4-yl)-N-[2-(1,3-thiazol-2-yl)ethyl]ethanamine

C15H27N3S — CID 55175412

IUPAC1-(1-propylpiperidin-4-yl)-N-[2-(1,3-thiazol-2-yl)ethyl]ethanamine
SMILESCCCN1CCC(C(C)NCCc2nccs2)CC1
InChIInChI=1S/C15H27N3S/c1-3-9-18-10-5-14(6-11-18)13(2)16-7-4-15-17-8-12-19-15/h8,12-14,16H,3-7,9-11H2,1-2H3
InChIKeyQXEBDYRIMOMUAJ-UHFFFAOYSA-N
MW281.47 g/mol
LogP2.79
Rot. Bonds7

About 1-(1-propylpiperidin-4-yl)-N-[2-(1,3-thiazol-2-yl)ethyl]ethanamine

1-(1-propylpiperidin-4-yl)-N-[2-(1,3-thiazol-2-yl)ethyl]ethanamine (PubChem CID 55175412) has the molecular formula C15H27N3S and a molecular weight of 281.47 g/mol. Its IUPAC name is 1-(1-propylpiperidin-4-yl)-N-[2-(1,3-thiazol-2-yl)ethyl]ethanamine.

Molecular Properties

Compound Name1-(1-propylpiperidin-4-yl)-N-[2-(1,3-thiazol-2-yl)ethyl]ethanamine
PubChem CID55175412
Molecular FormulaC15H27N3S
Molecular Weight281.47 g/mol
Exact Mass281.19
IUPAC Name1-(1-propylpiperidin-4-yl)-N-[2-(1,3-thiazol-2-yl)ethyl]ethanamine
SMILESCCCN1CCC(C(C)NCCc2nccs2)CC1
InChIInChI=1S/C15H27N3S/c1-3-9-18-10-5-14(6-11-18)13(2)16-7-4-15-17-8-12-19-15/h8,12-14,16H,3-7,9-11H2,1-2H3
InChIKeyQXEBDYRIMOMUAJ-UHFFFAOYSA-N
XLogP2.79
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.47
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(1-methylpiperidin-4-yl)-N-[2-(1,3-thiazol-2-yl)ethyl]ethanamine
CID 55175411
N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]-1-(1-propylpiperidin-4-yl)ethanamine
CID 106038848
1-cyclobutyl-N-[2-(1,3-thiazol-2-yl)ethyl]propan-2-amine
CID 115715095
N-[1-(1-propylpiperidin-4-yl)ethyl]octan-1-amine
CID 115566698
3-ethylsulfanyl-N-[1-(1-propylpiperidin-4-yl)ethyl]propan-1-amine
CID 114247777
(1R)-1-cyclohexyl-N-(1,3-thiazol-2-ylmethyl)ethanamine
CID 81384667
N'-[1-(1-propylpiperidin-4-yl)ethyl]butane-1,4-diamine
CID 60893438
N-methyl-1-[2-(1,3-thiazol-2-yl)ethyl]pyrrolidin-3-amine
CID 63242038
N-[1-(1-propylpiperidin-4-yl)ethyl]pent-3-yn-1-amine
CID 116642856
7-methyl-N-[1-(1-propylpiperidin-4-yl)ethyl]octan-1-amine
CID 43308547
1-[1-(1-propylpiperidin-4-yl)ethylamino]pentan-3-ol
CID 113497532
N'-ethyl-N'-methyl-N-[1-(1-propylpiperidin-4-yl)ethyl]ethane-1,2-diamine
CID 62635023

Frequently Asked Questions

What is the IUPAC name of 1-(1-propylpiperidin-4-yl)-N-[2-(1,3-thiazol-2-yl)ethyl]ethanamine?
The IUPAC name of 1-(1-propylpiperidin-4-yl)-N-[2-(1,3-thiazol-2-yl)ethyl]ethanamine (CID 55175412) is 1-(1-propylpiperidin-4-yl)-N-[2-(1,3-thiazol-2-yl)ethyl]ethanamine.
What is the SMILES notation for 1-(1-propylpiperidin-4-yl)-N-[2-(1,3-thiazol-2-yl)ethyl]ethanamine?
The canonical SMILES for 1-(1-propylpiperidin-4-yl)-N-[2-(1,3-thiazol-2-yl)ethyl]ethanamine is CCCN1CCC(C(C)NCCc2nccs2)CC1.
What is the InChIKey of 1-(1-propylpiperidin-4-yl)-N-[2-(1,3-thiazol-2-yl)ethyl]ethanamine?
The InChIKey is QXEBDYRIMOMUAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3S/c1-3-9-18-10-5-14(6-11-18)13(2)16-7-4-15-17-8-12-19-15/h8,12-14,16H,3-7,9-11H2,1-2H3.
What are the key properties of 1-(1-propylpiperidin-4-yl)-N-[2-(1,3-thiazol-2-yl)ethyl]ethanamine?
1-(1-propylpiperidin-4-yl)-N-[2-(1,3-thiazol-2-yl)ethyl]ethanamine has a molecular weight of 281.47 g/mol, XLogP of 2.79, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-propylpiperidin-4-yl)-N-[2-(1,3-thiazol-2-yl)ethyl]ethanamine is sourced from PubChem (CID 55175412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).