3-methoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide

C11H19F3N2O2 — CID 62590040

IUPAC3-methoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide
SMILESCOCCC(=O)N(CC(F)(F)F)C1CCNCC1
InChIInChI=1S/C11H19F3N2O2/c1-18-7-4-10(17)16(8-11(12,13)14)9-2-5-15-6-3-9/h9,15H,2-8H2,1H3
InChIKeyOZYHLVVIDCGSKU-UHFFFAOYSA-N
MW268.28 g/mol
LogP1.17
Rot. Bonds5

About 3-methoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide

3-methoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide (PubChem CID 62590040) has the molecular formula C11H19F3N2O2 and a molecular weight of 268.28 g/mol. Its IUPAC name is 3-methoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide.

Molecular Properties

Compound Name3-methoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide
PubChem CID62590040
Molecular FormulaC11H19F3N2O2
Molecular Weight268.28 g/mol
Exact Mass268.14
IUPAC Name3-methoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide
SMILESCOCCC(=O)N(CC(F)(F)F)C1CCNCC1
InChIInChI=1S/C11H19F3N2O2/c1-18-7-4-10(17)16(8-11(12,13)14)9-2-5-15-6-3-9/h9,15H,2-8H2,1H3
InChIKeyOZYHLVVIDCGSKU-UHFFFAOYSA-N
XLogP1.17
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.28
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide?
The IUPAC name of 3-methoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide (CID 62590040) is 3-methoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide.
What is the SMILES notation for 3-methoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide?
The canonical SMILES for 3-methoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide is COCCC(=O)N(CC(F)(F)F)C1CCNCC1.
What is the InChIKey of 3-methoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide?
The InChIKey is OZYHLVVIDCGSKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19F3N2O2/c1-18-7-4-10(17)16(8-11(12,13)14)9-2-5-15-6-3-9/h9,15H,2-8H2,1H3.
What are the key properties of 3-methoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide?
3-methoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide has a molecular weight of 268.28 g/mol, XLogP of 1.17, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide is sourced from PubChem (CID 62590040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).