2-methoxy-N-[6-(trifluoromethyl)piperidin-3-yl]propanamide

C10H17F3N2O2 — CID 113374757

IUPAC2-methoxy-N-[6-(trifluoromethyl)piperidin-3-yl]propanamide
SMILESCOC(C)C(=O)NC1CCC(C(F)(F)F)NC1
InChIInChI=1S/C10H17F3N2O2/c1-6(17-2)9(16)15-7-3-4-8(14-5-7)10(11,12)13/h6-8,14H,3-5H2,1-2H3,(H,15,16)
InChIKeyIVOQUBPKQHSZLU-UHFFFAOYSA-N
MW254.25 g/mol
LogP0.82
Rot. Bonds3

About 2-methoxy-N-[6-(trifluoromethyl)piperidin-3-yl]propanamide

2-methoxy-N-[6-(trifluoromethyl)piperidin-3-yl]propanamide (PubChem CID 113374757) has the molecular formula C10H17F3N2O2 and a molecular weight of 254.25 g/mol. Its IUPAC name is 2-methoxy-N-[6-(trifluoromethyl)piperidin-3-yl]propanamide.

Molecular Properties

Compound Name2-methoxy-N-[6-(trifluoromethyl)piperidin-3-yl]propanamide
PubChem CID113374757
Molecular FormulaC10H17F3N2O2
Molecular Weight254.25 g/mol
Exact Mass254.12
IUPAC Name2-methoxy-N-[6-(trifluoromethyl)piperidin-3-yl]propanamide
SMILESCOC(C)C(=O)NC1CCC(C(F)(F)F)NC1
InChIInChI=1S/C10H17F3N2O2/c1-6(17-2)9(16)15-7-3-4-8(14-5-7)10(11,12)13/h6-8,14H,3-5H2,1-2H3,(H,15,16)
InChIKeyIVOQUBPKQHSZLU-UHFFFAOYSA-N
XLogP0.82
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.25
LogP ≤ 50.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-3-[6-(trifluoromethyl)piperidin-3-yl]urea
CID 82810862
2-[(2-methylpropan-2-yl)oxy]-N-[6-(trifluoromethyl)piperidin-3-yl]acetamide
CID 112602539
4,4,4-trifluoro-N-[6-(trifluoromethyl)piperidin-3-yl]butanamide
CID 82811943
N-[6-(trifluoromethyl)piperidin-3-yl]hexanamide
CID 82811806
2-methoxy-N-(3-methylcyclopentyl)propanamide
CID 114541432
2-methoxy-N-[(3S)-piperidin-3-yl]propanamide
CID 103866505
1,1-difluoro-N-[6-(trifluoromethyl)piperidin-3-yl]methanesulfonamide
CID 82816995
2-methoxy-N-(2-methylpiperidin-4-yl)propanamide
CID 106995606
1-(4-fluorophenyl)-3-[6-(trifluoromethyl)piperidin-3-yl]urea
CID 82794523
N-(4-ethylcyclohexyl)-2-methoxypropanamide
CID 115588230
N-(8-azabicyclo[3.2.1]octan-3-yl)-2-methoxypropanamide
CID 115736861
3,3,3-trifluoro-N-(6-methylpiperidin-3-yl)-2-(trifluoromethyl)propanamide
CID 103309477

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[6-(trifluoromethyl)piperidin-3-yl]propanamide?
The IUPAC name of 2-methoxy-N-[6-(trifluoromethyl)piperidin-3-yl]propanamide (CID 113374757) is 2-methoxy-N-[6-(trifluoromethyl)piperidin-3-yl]propanamide.
What is the SMILES notation for 2-methoxy-N-[6-(trifluoromethyl)piperidin-3-yl]propanamide?
The canonical SMILES for 2-methoxy-N-[6-(trifluoromethyl)piperidin-3-yl]propanamide is COC(C)C(=O)NC1CCC(C(F)(F)F)NC1.
What is the InChIKey of 2-methoxy-N-[6-(trifluoromethyl)piperidin-3-yl]propanamide?
The InChIKey is IVOQUBPKQHSZLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F3N2O2/c1-6(17-2)9(16)15-7-3-4-8(14-5-7)10(11,12)13/h6-8,14H,3-5H2,1-2H3,(H,15,16).
What are the key properties of 2-methoxy-N-[6-(trifluoromethyl)piperidin-3-yl]propanamide?
2-methoxy-N-[6-(trifluoromethyl)piperidin-3-yl]propanamide has a molecular weight of 254.25 g/mol, XLogP of 0.82, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[6-(trifluoromethyl)piperidin-3-yl]propanamide is sourced from PubChem (CID 113374757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).