2,5-di(piperidin-1-yl)-1,3-thiazole

C13H21N3S — CID 142796895

IUPAC2,5-di(piperidin-1-yl)-1,3-thiazole
SMILESc1nc(N2CCCCC2)sc1N1CCCCC1
InChIInChI=1S/C13H21N3S/c1-3-7-15(8-4-1)12-11-14-13(17-12)16-9-5-2-6-10-16/h11H,1-10H2
InChIKeyHJLCLGYBXIHGAI-UHFFFAOYSA-N
MW251.40 g/mol
LogP3.12
Rot. Bonds2

About 2,5-di(piperidin-1-yl)-1,3-thiazole

2,5-di(piperidin-1-yl)-1,3-thiazole (PubChem CID 142796895) has the molecular formula C13H21N3S and a molecular weight of 251.40 g/mol. Its IUPAC name is 2,5-di(piperidin-1-yl)-1,3-thiazole.

Molecular Properties

Compound Name2,5-di(piperidin-1-yl)-1,3-thiazole
PubChem CID142796895
Molecular FormulaC13H21N3S
Molecular Weight251.40 g/mol
Exact Mass251.15
IUPAC Name2,5-di(piperidin-1-yl)-1,3-thiazole
SMILESc1nc(N2CCCCC2)sc1N1CCCCC1
InChIInChI=1S/C13H21N3S/c1-3-7-15(8-4-1)12-11-14-13(17-12)16-9-5-2-6-10-16/h11H,1-10H2
InChIKeyHJLCLGYBXIHGAI-UHFFFAOYSA-N
XLogP3.12
TPSA19.37 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.40
LogP ≤ 53.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-(5-Bromo-1,3-thiazol-2-yl)piperidine
CID 45787550
1-(1,3-Thiazol-2-yl)piperidine
CID 15110477
2-(3-Fluoropiperidin-1-yl)-1,3-thiazole
CID 145898296
4-[5-(4-Fluoropiperidin-1-yl)-1,3-thiazol-2-yl]morpholine
CID 150585310
1-(2-Fluorocyclopentyl)-4-(1,3-thiazol-2-yl)piperazine
CID 126857870
2-(4,4-Difluoropiperidin-1-yl)-1,3-thiazol-5-amine
CID 164645643
N-(2-piperidin-1-ylethyl)-1,3-thiazol-2-amine
CID 17884345
2-(4-Propylpiperazin-1-yl)-1,3-thiazole
CID 53529496
2-Amino-5-(piperidino)thiazole
CID 66520357
5-Amino-2-(4-methylpiperidin-1-yl)thiazole
CID 66520647
2-(1-Sulfidopiperidin-1-ium-1-yl)-1,3-thiazole
CID 66971614
2-(3,4-Dimethylpiperidin-1-yl)-1,3-thiazol-5-amine
CID 70792024

Frequently Asked Questions

What is the IUPAC name of 2,5-di(piperidin-1-yl)-1,3-thiazole?
The IUPAC name of 2,5-di(piperidin-1-yl)-1,3-thiazole (CID 142796895) is 2,5-di(piperidin-1-yl)-1,3-thiazole.
What is the SMILES notation for 2,5-di(piperidin-1-yl)-1,3-thiazole?
The canonical SMILES for 2,5-di(piperidin-1-yl)-1,3-thiazole is c1nc(N2CCCCC2)sc1N1CCCCC1.
What is the InChIKey of 2,5-di(piperidin-1-yl)-1,3-thiazole?
The InChIKey is HJLCLGYBXIHGAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3S/c1-3-7-15(8-4-1)12-11-14-13(17-12)16-9-5-2-6-10-16/h11H,1-10H2.
What are the key properties of 2,5-di(piperidin-1-yl)-1,3-thiazole?
2,5-di(piperidin-1-yl)-1,3-thiazole has a molecular weight of 251.40 g/mol, XLogP of 3.12, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-di(piperidin-1-yl)-1,3-thiazole is sourced from PubChem (CID 142796895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).