2-(1-cyclopentylpiperidin-4-yl)-1,3-thiazole

C13H20N2S — CID 127720340

IUPAC2-(1-cyclopentylpiperidin-4-yl)-1,3-thiazole
SMILESc1csc(C2CCN(C3CCCC3)CC2)n1
InChIInChI=1S/C13H20N2S/c1-2-4-12(3-1)15-8-5-11(6-9-15)13-14-7-10-16-13/h7,10-12H,1-6,8-9H2
InChIKeyLYWZFQBTDXBOSS-UHFFFAOYSA-N
MW236.38 g/mol
LogP3.27
Rot. Bonds2

About 2-(1-cyclopentylpiperidin-4-yl)-1,3-thiazole

2-(1-cyclopentylpiperidin-4-yl)-1,3-thiazole (PubChem CID 127720340) has the molecular formula C13H20N2S and a molecular weight of 236.38 g/mol. Its IUPAC name is 2-(1-cyclopentylpiperidin-4-yl)-1,3-thiazole.

Molecular Properties

Compound Name2-(1-cyclopentylpiperidin-4-yl)-1,3-thiazole
PubChem CID127720340
Molecular FormulaC13H20N2S
Molecular Weight236.38 g/mol
Exact Mass236.13
IUPAC Name2-(1-cyclopentylpiperidin-4-yl)-1,3-thiazole
SMILESc1csc(C2CCN(C3CCCC3)CC2)n1
InChIInChI=1S/C13H20N2S/c1-2-4-12(3-1)15-8-5-11(6-9-15)13-14-7-10-16-13/h7,10-12H,1-6,8-9H2
InChIKeyLYWZFQBTDXBOSS-UHFFFAOYSA-N
XLogP3.27
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.38
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(1-cyclopentylpiperidin-4-yl)-1,3-thiazole?
The IUPAC name of 2-(1-cyclopentylpiperidin-4-yl)-1,3-thiazole (CID 127720340) is 2-(1-cyclopentylpiperidin-4-yl)-1,3-thiazole.
What is the SMILES notation for 2-(1-cyclopentylpiperidin-4-yl)-1,3-thiazole?
The canonical SMILES for 2-(1-cyclopentylpiperidin-4-yl)-1,3-thiazole is c1csc(C2CCN(C3CCCC3)CC2)n1.
What is the InChIKey of 2-(1-cyclopentylpiperidin-4-yl)-1,3-thiazole?
The InChIKey is LYWZFQBTDXBOSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2S/c1-2-4-12(3-1)15-8-5-11(6-9-15)13-14-7-10-16-13/h7,10-12H,1-6,8-9H2.
What are the key properties of 2-(1-cyclopentylpiperidin-4-yl)-1,3-thiazole?
2-(1-cyclopentylpiperidin-4-yl)-1,3-thiazole has a molecular weight of 236.38 g/mol, XLogP of 3.27, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-cyclopentylpiperidin-4-yl)-1,3-thiazole is sourced from PubChem (CID 127720340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).