4-(2-methylpropyl)-2-(2-piperidin-2-ylethyl)-1,3-thiazole

C14H24N2S — CID 116968484

IUPAC4-(2-methylpropyl)-2-(2-piperidin-2-ylethyl)-1,3-thiazole
SMILESCC(C)Cc1csc(CCC2CCCCN2)n1
InChIInChI=1S/C14H24N2S/c1-11(2)9-13-10-17-14(16-13)7-6-12-5-3-4-8-15-12/h10-12,15H,3-9H2,1-2H3
InChIKeyHAOWKQNYVGYEAA-UHFFFAOYSA-N
MW252.43 g/mol
LogP3.42
Rot. Bonds5

About 4-(2-methylpropyl)-2-(2-piperidin-2-ylethyl)-1,3-thiazole

4-(2-methylpropyl)-2-(2-piperidin-2-ylethyl)-1,3-thiazole (PubChem CID 116968484) has the molecular formula C14H24N2S and a molecular weight of 252.43 g/mol. Its IUPAC name is 4-(2-methylpropyl)-2-(2-piperidin-2-ylethyl)-1,3-thiazole.

Molecular Properties

Compound Name4-(2-methylpropyl)-2-(2-piperidin-2-ylethyl)-1,3-thiazole
PubChem CID116968484
Molecular FormulaC14H24N2S
Molecular Weight252.43 g/mol
Exact Mass252.17
IUPAC Name4-(2-methylpropyl)-2-(2-piperidin-2-ylethyl)-1,3-thiazole
SMILESCC(C)Cc1csc(CCC2CCCCN2)n1
InChIInChI=1S/C14H24N2S/c1-11(2)9-13-10-17-14(16-13)7-6-12-5-3-4-8-15-12/h10-12,15H,3-9H2,1-2H3
InChIKeyHAOWKQNYVGYEAA-UHFFFAOYSA-N
XLogP3.42
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.43
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(piperidin-2-ylmethyl)-2-propyl-1,3-thiazole
CID 116888787
4-phenyl-2-(2-piperidin-2-ylethyl)-1,3-thiazole
CID 79817603
1-[2-(pyrrolidin-2-ylmethyl)-1,3-thiazol-4-yl]propan-2-one
CID 115088645
4-(2-methylpropyl)-2-undecyl-1,3-thiazole
CID 122184889
(2S)-2-(3-methylbutyl)piperidine
CID 94379266
2-cyclobutyl-4-(2-methylpropyl)-1,3-thiazole
CID 130891959
4-bromo-2-(piperidin-2-ylmethyl)-1,3-thiazole
CID 83693596
4-methyl-6-(2-methylpropyl)-2-piperidin-2-ylpyrimidine
CID 116893407
2-[2-(4-bromothiophen-2-yl)ethyl]azepane
CID 107355607
5-methyl-2-(2-piperidin-2-ylethyl)-1,3-benzothiazole
CID 55049751
2-[2-(4-methylpiperazin-2-yl)ethyl]-4-propan-2-yl-1,3-thiazole
CID 116969147
2-methyl-3-[4-(2-methylpropyl)-1,3-thiazol-2-yl]propan-1-amine
CID 116965082

Frequently Asked Questions

What is the IUPAC name of 4-(2-methylpropyl)-2-(2-piperidin-2-ylethyl)-1,3-thiazole?
The IUPAC name of 4-(2-methylpropyl)-2-(2-piperidin-2-ylethyl)-1,3-thiazole (CID 116968484) is 4-(2-methylpropyl)-2-(2-piperidin-2-ylethyl)-1,3-thiazole.
What is the SMILES notation for 4-(2-methylpropyl)-2-(2-piperidin-2-ylethyl)-1,3-thiazole?
The canonical SMILES for 4-(2-methylpropyl)-2-(2-piperidin-2-ylethyl)-1,3-thiazole is CC(C)Cc1csc(CCC2CCCCN2)n1.
What is the InChIKey of 4-(2-methylpropyl)-2-(2-piperidin-2-ylethyl)-1,3-thiazole?
The InChIKey is HAOWKQNYVGYEAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2S/c1-11(2)9-13-10-17-14(16-13)7-6-12-5-3-4-8-15-12/h10-12,15H,3-9H2,1-2H3.
What are the key properties of 4-(2-methylpropyl)-2-(2-piperidin-2-ylethyl)-1,3-thiazole?
4-(2-methylpropyl)-2-(2-piperidin-2-ylethyl)-1,3-thiazole has a molecular weight of 252.43 g/mol, XLogP of 3.42, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylpropyl)-2-(2-piperidin-2-ylethyl)-1,3-thiazole is sourced from PubChem (CID 116968484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).