2-[(2R)-1-[6-(2,2,2-trifluoroethoxy)pyridine-3-carbonyl]piperidin-2-yl]acetamide

C15H18F3N3O3 — CID 95286122

IUPAC2-[(2R)-1-[6-(2,2,2-trifluoroethoxy)pyridine-3-carbonyl]piperidin-2-yl]acetamide
SMILESNC(=O)C[C@H]1CCCCN1C(=O)c1ccc(OCC(F)(F)F)nc1
InChIInChI=1S/C15H18F3N3O3/c16-15(17,18)9-24-13-5-4-10(8-20-13)14(23)21-6-2-1-3-11(21)7-12(19)22/h4-5,8,11H,1-3,6-7,9H2,(H2,19,22)/t11-/m1/s1
InChIKeyUWFQSUOBUPUWFT-LLVKDONJSA-N
MW345.32 g/mol
LogP1.89
Rot. Bonds5

About 2-[(2R)-1-[6-(2,2,2-trifluoroethoxy)pyridine-3-carbonyl]piperidin-2-yl]acetamide

2-[(2R)-1-[6-(2,2,2-trifluoroethoxy)pyridine-3-carbonyl]piperidin-2-yl]acetamide (PubChem CID 95286122) has the molecular formula C15H18F3N3O3 and a molecular weight of 345.32 g/mol. Its IUPAC name is 2-[(2R)-1-[6-(2,2,2-trifluoroethoxy)pyridine-3-carbonyl]piperidin-2-yl]acetamide.

Molecular Properties

Compound Name2-[(2R)-1-[6-(2,2,2-trifluoroethoxy)pyridine-3-carbonyl]piperidin-2-yl]acetamide
PubChem CID95286122
Molecular FormulaC15H18F3N3O3
Molecular Weight345.32 g/mol
Exact Mass345.13
IUPAC Name2-[(2R)-1-[6-(2,2,2-trifluoroethoxy)pyridine-3-carbonyl]piperidin-2-yl]acetamide
SMILESNC(=O)C[C@H]1CCCCN1C(=O)c1ccc(OCC(F)(F)F)nc1
InChIInChI=1S/C15H18F3N3O3/c16-15(17,18)9-24-13-5-4-10(8-20-13)14(23)21-6-2-1-3-11(21)7-12(19)22/h4-5,8,11H,1-3,6-7,9H2,(H2,19,22)/t11-/m1/s1
InChIKeyUWFQSUOBUPUWFT-LLVKDONJSA-N
XLogP1.89
TPSA85.52 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.32
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[3-(methylamino)piperidin-1-yl]-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]methanone
CID 119490982
[(4S)-4-(dimethylamino)azepan-1-yl]-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]methanone
CID 100636861
N-(2-aminoethyl)-1-[6-(2,2,2-trifluoroethoxy)pyridine-3-carbonyl]piperidine-3-carboxamide
CID 119480989
6-[4-[2-(2-amino-2-oxoethyl)piperidine-1-carbonyl]phenyl]pyrazine-2-carboxamide
CID 122565079
2-[(2R)-1-(4-pyrrol-1-ylbenzoyl)piperidin-2-yl]acetamide
CID 94818861
6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide;hydrochloride
CID 165153609
2-[1-[3-chloro-5-(trifluoromethyl)benzoyl]piperidin-2-yl]acetamide
CID 91649837
2-[(2R)-1-(2,3-dihydro-1H-indene-5-carbonyl)piperidin-2-yl]acetamide
CID 95293673
2-[(2S)-1-[4-(3-methyl-4-pyridinyl)benzoyl]piperidin-2-yl]acetamide
CID 126442431
2-[1-(6-methylpyridine-3-carbonyl)piperidin-2-yl]acetic acid
CID 54899855
(6-ethoxy-3-pyridinyl)-[(2R)-2-(pyrazol-1-ylmethyl)piperidin-1-yl]methanone
CID 95347058
[4-(4-chlorophenoxy)piperidin-1-yl]-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]methanone
CID 67169308

Frequently Asked Questions

What is the IUPAC name of 2-[(2R)-1-[6-(2,2,2-trifluoroethoxy)pyridine-3-carbonyl]piperidin-2-yl]acetamide?
The IUPAC name of 2-[(2R)-1-[6-(2,2,2-trifluoroethoxy)pyridine-3-carbonyl]piperidin-2-yl]acetamide (CID 95286122) is 2-[(2R)-1-[6-(2,2,2-trifluoroethoxy)pyridine-3-carbonyl]piperidin-2-yl]acetamide.
What is the SMILES notation for 2-[(2R)-1-[6-(2,2,2-trifluoroethoxy)pyridine-3-carbonyl]piperidin-2-yl]acetamide?
The canonical SMILES for 2-[(2R)-1-[6-(2,2,2-trifluoroethoxy)pyridine-3-carbonyl]piperidin-2-yl]acetamide is NC(=O)C[C@H]1CCCCN1C(=O)c1ccc(OCC(F)(F)F)nc1.
What is the InChIKey of 2-[(2R)-1-[6-(2,2,2-trifluoroethoxy)pyridine-3-carbonyl]piperidin-2-yl]acetamide?
The InChIKey is UWFQSUOBUPUWFT-LLVKDONJSA-N. The full InChI is InChI=1S/C15H18F3N3O3/c16-15(17,18)9-24-13-5-4-10(8-20-13)14(23)21-6-2-1-3-11(21)7-12(19)22/h4-5,8,11H,1-3,6-7,9H2,(H2,19,22)/t11-/m1/s1.
What are the key properties of 2-[(2R)-1-[6-(2,2,2-trifluoroethoxy)pyridine-3-carbonyl]piperidin-2-yl]acetamide?
2-[(2R)-1-[6-(2,2,2-trifluoroethoxy)pyridine-3-carbonyl]piperidin-2-yl]acetamide has a molecular weight of 345.32 g/mol, XLogP of 1.89, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R)-1-[6-(2,2,2-trifluoroethoxy)pyridine-3-carbonyl]piperidin-2-yl]acetamide is sourced from PubChem (CID 95286122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).