N-[2-oxo-1-(2,2,2-trifluoroethyl)-3-pyridinyl]acetamide

C9H9F3N2O2 — CID 97223378

IUPACN-[2-oxo-1-(2,2,2-trifluoroethyl)-3-pyridinyl]acetamide
SMILESCC(=O)Nc1cccn(CC(F)(F)F)c1=O
InChIInChI=1S/C9H9F3N2O2/c1-6(15)13-7-3-2-4-14(8(7)16)5-9(10,11)12/h2-4H,5H2,1H3,(H,13,15)
InChIKeyMANBAPIZCRXEQQ-UHFFFAOYSA-N
MW234.18 g/mol
LogP1.37
Rot. Bonds2

About N-[2-oxo-1-(2,2,2-trifluoroethyl)-3-pyridinyl]acetamide

N-[2-oxo-1-(2,2,2-trifluoroethyl)-3-pyridinyl]acetamide (PubChem CID 97223378) has the molecular formula C9H9F3N2O2 and a molecular weight of 234.18 g/mol. Its IUPAC name is N-[2-oxo-1-(2,2,2-trifluoroethyl)-3-pyridinyl]acetamide.

Molecular Properties

Compound NameN-[2-oxo-1-(2,2,2-trifluoroethyl)-3-pyridinyl]acetamide
PubChem CID97223378
Molecular FormulaC9H9F3N2O2
Molecular Weight234.18 g/mol
Exact Mass234.06
IUPAC NameN-[2-oxo-1-(2,2,2-trifluoroethyl)-3-pyridinyl]acetamide
SMILESCC(=O)Nc1cccn(CC(F)(F)F)c1=O
InChIInChI=1S/C9H9F3N2O2/c1-6(15)13-7-3-2-4-14(8(7)16)5-9(10,11)12/h2-4H,5H2,1H3,(H,13,15)
InChIKeyMANBAPIZCRXEQQ-UHFFFAOYSA-N
XLogP1.37
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.18
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-Oxo-5-(trifluoromethyl)-1,2-dihydropyridin-3-yl)acetamide
CID 47137243
3-Amino-1-ethyl-1,2-dihydropyridin-2-one
CID 18718035
N-(1-Methyl-6-oxo-1,6-dihydropyridin-3-yl)acetamide
CID 61151185
N-(2-hydroxypyridin-3-yl)prop-2-enamide
CID 156600118
6-hydroxy-N-(propan-2-yl)pyridine-2-carboxamide
CID 15334838
5-Amino-1-(2-(dimethylamino)ethyl)-1,2-dihydropyridin-2-one
CID 20113138
3-Amino-1-ethyl-6-(trifluoromethyl)-1,2-dihydropyridin-2-one
CID 39871946
5-Amino-1-(2,2-difluoroethyl)-1,2-dihydropyridin-2-one
CID 60922538
3-Amino-1-(2,2,2-trifluoroethyl)-1,2-dihydropyridin-2-one
CID 62101459
3-Amino-1-(1-methylethyl)-2(1H)-pyridinone
CID 82466688
3-Amino-1-(difluoromethyl)-1,2-dihydropyridin-2-one
CID 97354660
2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]-N-propan-2-ylacetamide
CID 7633456

Frequently Asked Questions

What is the IUPAC name of N-[2-oxo-1-(2,2,2-trifluoroethyl)-3-pyridinyl]acetamide?
The IUPAC name of N-[2-oxo-1-(2,2,2-trifluoroethyl)-3-pyridinyl]acetamide (CID 97223378) is N-[2-oxo-1-(2,2,2-trifluoroethyl)-3-pyridinyl]acetamide.
What is the SMILES notation for N-[2-oxo-1-(2,2,2-trifluoroethyl)-3-pyridinyl]acetamide?
The canonical SMILES for N-[2-oxo-1-(2,2,2-trifluoroethyl)-3-pyridinyl]acetamide is CC(=O)Nc1cccn(CC(F)(F)F)c1=O.
What is the InChIKey of N-[2-oxo-1-(2,2,2-trifluoroethyl)-3-pyridinyl]acetamide?
The InChIKey is MANBAPIZCRXEQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9F3N2O2/c1-6(15)13-7-3-2-4-14(8(7)16)5-9(10,11)12/h2-4H,5H2,1H3,(H,13,15).
What are the key properties of N-[2-oxo-1-(2,2,2-trifluoroethyl)-3-pyridinyl]acetamide?
N-[2-oxo-1-(2,2,2-trifluoroethyl)-3-pyridinyl]acetamide has a molecular weight of 234.18 g/mol, XLogP of 1.37, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-oxo-1-(2,2,2-trifluoroethyl)-3-pyridinyl]acetamide is sourced from PubChem (CID 97223378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).