sodium;hydride;6-(trifluoromethyl)-1H-pyridin-2-one

C6H5F3NNaO — CID 174986412

IUPACsodium;hydride;6-(trifluoromethyl)-1H-pyridin-2-one
SMILESO=c1cccc(C(F)(F)F)[nH]1.[H-].[Na+]
InChIInChI=1S/C6H4F3NO.Na.H/c7-6(8,9)4-2-1-3-5(11)10-4;;/h1-3H,(H,10,11);;/q;+1;-1
InChIKeyXZYLYVXVAGKKCW-UHFFFAOYSA-N
MW187.10 g/mol
LogP-1.49
Rot. Bonds

About sodium;hydride;6-(trifluoromethyl)-1H-pyridin-2-one

sodium;hydride;6-(trifluoromethyl)-1H-pyridin-2-one (PubChem CID 174986412) has the molecular formula C6H5F3NNaO and a molecular weight of 187.10 g/mol. Its IUPAC name is sodium;hydride;6-(trifluoromethyl)-1H-pyridin-2-one.

Molecular Properties

Compound Namesodium;hydride;6-(trifluoromethyl)-1H-pyridin-2-one
PubChem CID174986412
Molecular FormulaC6H5F3NNaO
Molecular Weight187.10 g/mol
Exact Mass187.02
IUPAC Namesodium;hydride;6-(trifluoromethyl)-1H-pyridin-2-one
SMILESO=c1cccc(C(F)(F)F)[nH]1.[H-].[Na+]
InChIInChI=1S/C6H4F3NO.Na.H/c7-6(8,9)4-2-1-3-5(11)10-4;;/h1-3H,(H,10,11);;/q;+1;-1
InChIKeyXZYLYVXVAGKKCW-UHFFFAOYSA-N
XLogP-1.49
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.10
LogP ≤ 5-1.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2(1H)-Pyridinone, 6-(trifluoromethyl)-
CID 10154195
6-Methylpyridin-2-ol
CID 76772
2-Fluoro-6-hydroxypyridine
CID 2762887
5-Fluoro-6-methylpyridin-2(1H)-one
CID 72212935
4-Iodo-6-(trifluoromethyl)-1,2-dihydropyridin-2-one
CID 118704344
5-Chloro-6-(trifluoromethyl)pyridin-2-ol
CID 72183134
5-Methylene-3-pyrrolin-2-one
CID 13795019
6-[chloro(difluoro)methyl]-1H-pyridin-2-one
CID 10261690
6-(Difluoromethyl)pyridin-2(1H)-one
CID 10441812
2(1H)-Pyridinone, 6-(fluoromethyl)-
CID 10464359
3,5-difluoro-6-methyl-1H-pyridin-2-one
CID 20602953
2(1H)-Pyridinone, 6-methyl-3-(trifluoromethyl)-
CID 20767670

Frequently Asked Questions

What is the IUPAC name of sodium;hydride;6-(trifluoromethyl)-1H-pyridin-2-one?
The IUPAC name of sodium;hydride;6-(trifluoromethyl)-1H-pyridin-2-one (CID 174986412) is sodium;hydride;6-(trifluoromethyl)-1H-pyridin-2-one.
What is the SMILES notation for sodium;hydride;6-(trifluoromethyl)-1H-pyridin-2-one?
The canonical SMILES for sodium;hydride;6-(trifluoromethyl)-1H-pyridin-2-one is O=c1cccc(C(F)(F)F)[nH]1.[H-].[Na+].
What is the InChIKey of sodium;hydride;6-(trifluoromethyl)-1H-pyridin-2-one?
The InChIKey is XZYLYVXVAGKKCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4F3NO.Na.H/c7-6(8,9)4-2-1-3-5(11)10-4;;/h1-3H,(H,10,11);;/q;+1;-1.
What are the key properties of sodium;hydride;6-(trifluoromethyl)-1H-pyridin-2-one?
sodium;hydride;6-(trifluoromethyl)-1H-pyridin-2-one has a molecular weight of 187.10 g/mol, XLogP of -1.49, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;hydride;6-(trifluoromethyl)-1H-pyridin-2-one is sourced from PubChem (CID 174986412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).