N-methyl-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide

C9H9F3N2O2 — CID 7633461

IUPACN-methyl-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide
SMILESCNC(=O)Cn1cc(C(F)(F)F)ccc1=O
InChIInChI=1S/C9H9F3N2O2/c1-13-7(15)5-14-4-6(9(10,11)12)2-3-8(14)16/h2-4H,5H2,1H3,(H,13,15)
InChIKeyNZZAORDLVIBEBL-UHFFFAOYSA-N
MW234.18 g/mol
LogP0.61
Rot. Bonds2

About N-methyl-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide

N-methyl-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide (PubChem CID 7633461) has the molecular formula C9H9F3N2O2 and a molecular weight of 234.18 g/mol. Its IUPAC name is N-methyl-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide.

Molecular Properties

Compound NameN-methyl-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide
PubChem CID7633461
Molecular FormulaC9H9F3N2O2
Molecular Weight234.18 g/mol
Exact Mass234.06
IUPAC NameN-methyl-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide
SMILESCNC(=O)Cn1cc(C(F)(F)F)ccc1=O
InChIInChI=1S/C9H9F3N2O2/c1-13-7(15)5-14-4-6(9(10,11)12)2-3-8(14)16/h2-4H,5H2,1H3,(H,13,15)
InChIKeyNZZAORDLVIBEBL-UHFFFAOYSA-N
XLogP0.61
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 ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide?
The IUPAC name of N-methyl-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide (CID 7633461) is N-methyl-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide.
What is the SMILES notation for N-methyl-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide?
The canonical SMILES for N-methyl-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide is CNC(=O)Cn1cc(C(F)(F)F)ccc1=O.
What is the InChIKey of N-methyl-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide?
The InChIKey is NZZAORDLVIBEBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9F3N2O2/c1-13-7(15)5-14-4-6(9(10,11)12)2-3-8(14)16/h2-4H,5H2,1H3,(H,13,15).
What are the key properties of N-methyl-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide?
N-methyl-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide has a molecular weight of 234.18 g/mol, XLogP of 0.61, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide is sourced from PubChem (CID 7633461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).