N-ethyl-2,2,2-trifluoro-N-(1-methylpiperidin-4-yl)acetamide

C10H17F3N2O — CID 59870788

IUPACN-ethyl-2,2,2-trifluoro-N-(1-methylpiperidin-4-yl)acetamide
SMILESCCN(C(=O)C(F)(F)F)C1CCN(C)CC1
InChIInChI=1S/C10H17F3N2O/c1-3-15(9(16)10(11,12)13)8-4-6-14(2)7-5-8/h8H,3-7H2,1-2H3
InChIKeyXVNWHFNZKJIAGF-UHFFFAOYSA-N
MW238.25 g/mol
LogP1.49
Rot. Bonds2

About N-ethyl-2,2,2-trifluoro-N-(1-methylpiperidin-4-yl)acetamide

N-ethyl-2,2,2-trifluoro-N-(1-methylpiperidin-4-yl)acetamide (PubChem CID 59870788) has the molecular formula C10H17F3N2O and a molecular weight of 238.25 g/mol. Its IUPAC name is N-ethyl-2,2,2-trifluoro-N-(1-methylpiperidin-4-yl)acetamide.

Molecular Properties

Compound NameN-ethyl-2,2,2-trifluoro-N-(1-methylpiperidin-4-yl)acetamide
PubChem CID59870788
Molecular FormulaC10H17F3N2O
Molecular Weight238.25 g/mol
Exact Mass238.13
IUPAC NameN-ethyl-2,2,2-trifluoro-N-(1-methylpiperidin-4-yl)acetamide
SMILESCCN(C(=O)C(F)(F)F)C1CCN(C)CC1
InChIInChI=1S/C10H17F3N2O/c1-3-15(9(16)10(11,12)13)8-4-6-14(2)7-5-8/h8H,3-7H2,1-2H3
InChIKeyXVNWHFNZKJIAGF-UHFFFAOYSA-N
XLogP1.49
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.25
LogP ≤ 51.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-(Piperidin-1-yl)piperidin-1-yl)ethanone
CID 14571195
2,2,2-Trifluoro-1-(4-(piperidin-1-yl)piperidin-1-yl)ethanone
CID 24744899
2,2,2-Trifluoro-1-(4-isocyanatopiperidin-1-yl)ethanone
CID 2778967
N-methyl-3-sulfanyl-N-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]propanamide
CID 177680877
2,2,2-Trifluoro-1-(cis-3-fluoro-2-methylpiperidin-1-yl)ethan-1-one
CID 134827886
2,2,2-Trifluoro-1-(cis-5-fluoro-2-methylpiperidin-1-yl)ethan-1-one
CID 134827919
N-methyl-N-(1-methylpiperidin-4-yl)butanamide
CID 23202893
Acetamide, 2,2,2-trifluoro-N-(1-methylpiperidin-4-yl)-
CID 6421687
1-(4,4-Difluoropiperidin-1-yl)ethanone
CID 23402906
N-(1-ethylpiperidin-4-yl)-2,2,2-trifluoroacetamide
CID 62732802
N-[1-(2-fluoroethyl)piperidin-4-yl]acetamide
CID 130652776
N-cyclohexyl-2,2,2-trifluoro-N-propan-2-ylacetamide
CID 125502413

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,2,2-trifluoro-N-(1-methylpiperidin-4-yl)acetamide?
The IUPAC name of N-ethyl-2,2,2-trifluoro-N-(1-methylpiperidin-4-yl)acetamide (CID 59870788) is N-ethyl-2,2,2-trifluoro-N-(1-methylpiperidin-4-yl)acetamide.
What is the SMILES notation for N-ethyl-2,2,2-trifluoro-N-(1-methylpiperidin-4-yl)acetamide?
The canonical SMILES for N-ethyl-2,2,2-trifluoro-N-(1-methylpiperidin-4-yl)acetamide is CCN(C(=O)C(F)(F)F)C1CCN(C)CC1.
What is the InChIKey of N-ethyl-2,2,2-trifluoro-N-(1-methylpiperidin-4-yl)acetamide?
The InChIKey is XVNWHFNZKJIAGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F3N2O/c1-3-15(9(16)10(11,12)13)8-4-6-14(2)7-5-8/h8H,3-7H2,1-2H3.
What are the key properties of N-ethyl-2,2,2-trifluoro-N-(1-methylpiperidin-4-yl)acetamide?
N-ethyl-2,2,2-trifluoro-N-(1-methylpiperidin-4-yl)acetamide has a molecular weight of 238.25 g/mol, XLogP of 1.49, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,2,2-trifluoro-N-(1-methylpiperidin-4-yl)acetamide is sourced from PubChem (CID 59870788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).