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

C11H19F3N2O2 — CID 113374752

IUPAC2-methoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide
SMILESCOC(C)C(=O)N(CC(F)(F)F)C1CCNCC1
InChIInChI=1S/C11H19F3N2O2/c1-8(18-2)10(17)16(7-11(12,13)14)9-3-5-15-6-4-9/h8-9,15H,3-7H2,1-2H3
InChIKeyDMJMNZPVKHNWCX-UHFFFAOYSA-N
MW268.28 g/mol
LogP1.16
Rot. Bonds4

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

2-methoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide (PubChem CID 113374752) has the molecular formula C11H19F3N2O2 and a molecular weight of 268.28 g/mol. Its IUPAC name is 2-methoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide.

Molecular Properties

Compound Name2-methoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide
PubChem CID113374752
Molecular FormulaC11H19F3N2O2
Molecular Weight268.28 g/mol
Exact Mass268.14
IUPAC Name2-methoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide
SMILESCOC(C)C(=O)N(CC(F)(F)F)C1CCNCC1
InChIInChI=1S/C11H19F3N2O2/c1-8(18-2)10(17)16(7-11(12,13)14)9-3-5-15-6-4-9/h8-9,15H,3-7H2,1-2H3
InChIKeyDMJMNZPVKHNWCX-UHFFFAOYSA-N
XLogP1.16
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.28
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide?
The IUPAC name of 2-methoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide (CID 113374752) is 2-methoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide.
What is the SMILES notation for 2-methoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide?
The canonical SMILES for 2-methoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide is COC(C)C(=O)N(CC(F)(F)F)C1CCNCC1.
What is the InChIKey of 2-methoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide?
The InChIKey is DMJMNZPVKHNWCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19F3N2O2/c1-8(18-2)10(17)16(7-11(12,13)14)9-3-5-15-6-4-9/h8-9,15H,3-7H2,1-2H3.
What are the key properties of 2-methoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide?
2-methoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide has a molecular weight of 268.28 g/mol, XLogP of 1.16, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)propanamide is sourced from PubChem (CID 113374752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).