5-cyclobutyl-2-piperidin-2-yl-1,3-thiazole

C12H18N2S — CID 115033669

IUPAC5-cyclobutyl-2-piperidin-2-yl-1,3-thiazole
SMILESc1nc(C2CCCCN2)sc1C1CCC1
InChIInChI=1S/C12H18N2S/c1-2-7-13-10(6-1)12-14-8-11(15-12)9-4-3-5-9/h8-10,13H,1-7H2
InChIKeyPZGDVTFNMKLFJN-UHFFFAOYSA-N
MW222.36 g/mol
LogP3.23
Rot. Bonds2

About 5-cyclobutyl-2-piperidin-2-yl-1,3-thiazole

5-cyclobutyl-2-piperidin-2-yl-1,3-thiazole (PubChem CID 115033669) has the molecular formula C12H18N2S and a molecular weight of 222.36 g/mol. Its IUPAC name is 5-cyclobutyl-2-piperidin-2-yl-1,3-thiazole.

Molecular Properties

Compound Name5-cyclobutyl-2-piperidin-2-yl-1,3-thiazole
PubChem CID115033669
Molecular FormulaC12H18N2S
Molecular Weight222.36 g/mol
Exact Mass222.12
IUPAC Name5-cyclobutyl-2-piperidin-2-yl-1,3-thiazole
SMILESc1nc(C2CCCCN2)sc1C1CCC1
InChIInChI=1S/C12H18N2S/c1-2-7-13-10(6-1)12-14-8-11(15-12)9-4-3-5-9/h8-10,13H,1-7H2
InChIKeyPZGDVTFNMKLFJN-UHFFFAOYSA-N
XLogP3.23
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.36
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-piperidin-2-yl-1,3-thiazol-5-yl)ethanamine
CID 115090671
5-cyclohexyl-2-pyrrolidin-3-yl-1,3-thiazole
CID 115041800
N-methyl-2-[(2S)-piperidin-2-yl]-1,3-thiazole-5-carboxamide
CID 124955227
4-cyclopentyl-2-piperidin-2-yl-1,3-thiazole
CID 62634064
5-cyclopropyl-2-(piperidin-2-ylmethyl)-1,3-thiazole
CID 115033672
2-(azepan-2-yl)-[1,3]thiazolo[5,4-b]pyridine
CID 65335157
2-fluoro-5-[(2S)-piperidin-2-yl]pyridine
CID 55277900
2-cyclopentyl-4-methyl-5-piperidin-2-yl-1,3-thiazole
CID 116885109
5-piperidin-2-ylpyrimidin-2-amine
CID 82409904
2-[(2R)-pyrrolidin-2-yl]-1,3-thiazole
CID 7047975
4-(5-fluoro-2-pyridinyl)-2-piperidin-2-yl-1,3-thiazole
CID 83119545
N-methyl-3-(2-pyrrolidin-2-yl-1,3-thiazol-5-yl)propan-1-amine
CID 115090579

Frequently Asked Questions

What is the IUPAC name of 5-cyclobutyl-2-piperidin-2-yl-1,3-thiazole?
The IUPAC name of 5-cyclobutyl-2-piperidin-2-yl-1,3-thiazole (CID 115033669) is 5-cyclobutyl-2-piperidin-2-yl-1,3-thiazole.
What is the SMILES notation for 5-cyclobutyl-2-piperidin-2-yl-1,3-thiazole?
The canonical SMILES for 5-cyclobutyl-2-piperidin-2-yl-1,3-thiazole is c1nc(C2CCCCN2)sc1C1CCC1.
What is the InChIKey of 5-cyclobutyl-2-piperidin-2-yl-1,3-thiazole?
The InChIKey is PZGDVTFNMKLFJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2S/c1-2-7-13-10(6-1)12-14-8-11(15-12)9-4-3-5-9/h8-10,13H,1-7H2.
What are the key properties of 5-cyclobutyl-2-piperidin-2-yl-1,3-thiazole?
5-cyclobutyl-2-piperidin-2-yl-1,3-thiazole has a molecular weight of 222.36 g/mol, XLogP of 3.23, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclobutyl-2-piperidin-2-yl-1,3-thiazole is sourced from PubChem (CID 115033669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).