(3-methoxypiperidin-1-yl)-[4-methyl-2-(2-methylpropyl)-1,3-thiazol-5-yl]methanone

C15H24N2O2S — CID 75369392

IUPAC(3-methoxypiperidin-1-yl)-[4-methyl-2-(2-methylpropyl)-1,3-thiazol-5-yl]methanone
SMILESCOC1CCCN(C(=O)c2sc(CC(C)C)nc2C)C1
InChIInChI=1S/C15H24N2O2S/c1-10(2)8-13-16-11(3)14(20-13)15(18)17-7-5-6-12(9-17)19-4/h10,12H,5-9H2,1-4H3
InChIKeyGZBMABATLSFFKO-UHFFFAOYSA-N
MW296.44 g/mol
LogP2.90
Rot. Bonds4

About (3-methoxypiperidin-1-yl)-[4-methyl-2-(2-methylpropyl)-1,3-thiazol-5-yl]methanone

(3-methoxypiperidin-1-yl)-[4-methyl-2-(2-methylpropyl)-1,3-thiazol-5-yl]methanone (PubChem CID 75369392) has the molecular formula C15H24N2O2S and a molecular weight of 296.44 g/mol. Its IUPAC name is (3-methoxypiperidin-1-yl)-[4-methyl-2-(2-methylpropyl)-1,3-thiazol-5-yl]methanone.

Molecular Properties

Compound Name(3-methoxypiperidin-1-yl)-[4-methyl-2-(2-methylpropyl)-1,3-thiazol-5-yl]methanone
PubChem CID75369392
Molecular FormulaC15H24N2O2S
Molecular Weight296.44 g/mol
Exact Mass296.16
IUPAC Name(3-methoxypiperidin-1-yl)-[4-methyl-2-(2-methylpropyl)-1,3-thiazol-5-yl]methanone
SMILESCOC1CCCN(C(=O)c2sc(CC(C)C)nc2C)C1
InChIInChI=1S/C15H24N2O2S/c1-10(2)8-13-16-11(3)14(20-13)15(18)17-7-5-6-12(9-17)19-4/h10,12H,5-9H2,1-4H3
InChIKeyGZBMABATLSFFKO-UHFFFAOYSA-N
XLogP2.90
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.44
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (3-methoxypiperidin-1-yl)-[4-methyl-2-(2-methylpropyl)-1,3-thiazol-5-yl]methanone?
The IUPAC name of (3-methoxypiperidin-1-yl)-[4-methyl-2-(2-methylpropyl)-1,3-thiazol-5-yl]methanone (CID 75369392) is (3-methoxypiperidin-1-yl)-[4-methyl-2-(2-methylpropyl)-1,3-thiazol-5-yl]methanone.
What is the SMILES notation for (3-methoxypiperidin-1-yl)-[4-methyl-2-(2-methylpropyl)-1,3-thiazol-5-yl]methanone?
The canonical SMILES for (3-methoxypiperidin-1-yl)-[4-methyl-2-(2-methylpropyl)-1,3-thiazol-5-yl]methanone is COC1CCCN(C(=O)c2sc(CC(C)C)nc2C)C1.
What is the InChIKey of (3-methoxypiperidin-1-yl)-[4-methyl-2-(2-methylpropyl)-1,3-thiazol-5-yl]methanone?
The InChIKey is GZBMABATLSFFKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2S/c1-10(2)8-13-16-11(3)14(20-13)15(18)17-7-5-6-12(9-17)19-4/h10,12H,5-9H2,1-4H3.
What are the key properties of (3-methoxypiperidin-1-yl)-[4-methyl-2-(2-methylpropyl)-1,3-thiazol-5-yl]methanone?
(3-methoxypiperidin-1-yl)-[4-methyl-2-(2-methylpropyl)-1,3-thiazol-5-yl]methanone has a molecular weight of 296.44 g/mol, XLogP of 2.90, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methoxypiperidin-1-yl)-[4-methyl-2-(2-methylpropyl)-1,3-thiazol-5-yl]methanone is sourced from PubChem (CID 75369392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).