2-piperidin-4-yl-5-propan-2-yl-1,3-thiazole

C11H18N2S — CID 59766637

IUPAC2-piperidin-4-yl-5-propan-2-yl-1,3-thiazole
SMILESCC(C)c1cnc(C2CCNCC2)s1
InChIInChI=1S/C11H18N2S/c1-8(2)10-7-13-11(14-10)9-3-5-12-6-4-9/h7-9,12H,3-6H2,1-2H3
InChIKeyIQHAGZXGZHOKPP-UHFFFAOYSA-N
MW210.35 g/mol
LogP2.73
Rot. Bonds2

About 2-piperidin-4-yl-5-propan-2-yl-1,3-thiazole

2-piperidin-4-yl-5-propan-2-yl-1,3-thiazole (PubChem CID 59766637) has the molecular formula C11H18N2S and a molecular weight of 210.35 g/mol. Its IUPAC name is 2-piperidin-4-yl-5-propan-2-yl-1,3-thiazole.

Molecular Properties

Compound Name2-piperidin-4-yl-5-propan-2-yl-1,3-thiazole
PubChem CID59766637
Molecular FormulaC11H18N2S
Molecular Weight210.35 g/mol
Exact Mass210.12
IUPAC Name2-piperidin-4-yl-5-propan-2-yl-1,3-thiazole
SMILESCC(C)c1cnc(C2CCNCC2)s1
InChIInChI=1S/C11H18N2S/c1-8(2)10-7-13-11(14-10)9-3-5-12-6-4-9/h7-9,12H,3-6H2,1-2H3
InChIKeyIQHAGZXGZHOKPP-UHFFFAOYSA-N
XLogP2.73
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.35
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-piperidin-4-yl-5-propan-2-yl-1,3-thiazole?
The IUPAC name of 2-piperidin-4-yl-5-propan-2-yl-1,3-thiazole (CID 59766637) is 2-piperidin-4-yl-5-propan-2-yl-1,3-thiazole.
What is the SMILES notation for 2-piperidin-4-yl-5-propan-2-yl-1,3-thiazole?
The canonical SMILES for 2-piperidin-4-yl-5-propan-2-yl-1,3-thiazole is CC(C)c1cnc(C2CCNCC2)s1.
What is the InChIKey of 2-piperidin-4-yl-5-propan-2-yl-1,3-thiazole?
The InChIKey is IQHAGZXGZHOKPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2S/c1-8(2)10-7-13-11(14-10)9-3-5-12-6-4-9/h7-9,12H,3-6H2,1-2H3.
What are the key properties of 2-piperidin-4-yl-5-propan-2-yl-1,3-thiazole?
2-piperidin-4-yl-5-propan-2-yl-1,3-thiazole has a molecular weight of 210.35 g/mol, XLogP of 2.73, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperidin-4-yl-5-propan-2-yl-1,3-thiazole is sourced from PubChem (CID 59766637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).