2-(4-methoxypiperidin-1-yl)-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)acetamide

C14H25F3N2O2 — CID 78898292

IUPAC2-(4-methoxypiperidin-1-yl)-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)acetamide
SMILESCOC1CCN(CC(=O)N(CC(C)C)CC(F)(F)F)CC1
InChIInChI=1S/C14H25F3N2O2/c1-11(2)8-19(10-14(15,16)17)13(20)9-18-6-4-12(21-3)5-7-18/h11-12H,4-10H2,1-3H3
InChIKeyUSWZQUOAOQQMNI-UHFFFAOYSA-N
MW310.36 g/mol
LogP2.14
Rot. Bonds6

About 2-(4-methoxypiperidin-1-yl)-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)acetamide

2-(4-methoxypiperidin-1-yl)-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 78898292) has the molecular formula C14H25F3N2O2 and a molecular weight of 310.36 g/mol. Its IUPAC name is 2-(4-methoxypiperidin-1-yl)-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound Name2-(4-methoxypiperidin-1-yl)-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID78898292
Molecular FormulaC14H25F3N2O2
Molecular Weight310.36 g/mol
Exact Mass310.19
IUPAC Name2-(4-methoxypiperidin-1-yl)-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)acetamide
SMILESCOC1CCN(CC(=O)N(CC(C)C)CC(F)(F)F)CC1
InChIInChI=1S/C14H25F3N2O2/c1-11(2)8-19(10-14(15,16)17)13(20)9-18-6-4-12(21-3)5-7-18/h11-12H,4-10H2,1-3H3
InChIKeyUSWZQUOAOQQMNI-UHFFFAOYSA-N
XLogP2.14
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.36
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxypiperidin-1-yl)-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of 2-(4-methoxypiperidin-1-yl)-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)acetamide (CID 78898292) is 2-(4-methoxypiperidin-1-yl)-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for 2-(4-methoxypiperidin-1-yl)-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for 2-(4-methoxypiperidin-1-yl)-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)acetamide is COC1CCN(CC(=O)N(CC(C)C)CC(F)(F)F)CC1.
What is the InChIKey of 2-(4-methoxypiperidin-1-yl)-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is USWZQUOAOQQMNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25F3N2O2/c1-11(2)8-19(10-14(15,16)17)13(20)9-18-6-4-12(21-3)5-7-18/h11-12H,4-10H2,1-3H3.
What are the key properties of 2-(4-methoxypiperidin-1-yl)-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)acetamide?
2-(4-methoxypiperidin-1-yl)-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 310.36 g/mol, XLogP of 2.14, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxypiperidin-1-yl)-N-(2-methylpropyl)-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 78898292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).