5-(methylamino)-1-(trifluoromethyl)pyridin-2-one

C7H7F3N2O — CID 123383374

IUPAC5-(methylamino)-1-(trifluoromethyl)pyridin-2-one
SMILESCNc1ccc(=O)n(C(F)(F)F)c1
InChIInChI=1S/C7H7F3N2O/c1-11-5-2-3-6(13)12(4-5)7(8,9)10/h2-4,11H,1H3
InChIKeyRESSBKXHPAIURJ-UHFFFAOYSA-N
MW192.14 g/mol
LogP1.37
Rot. Bonds1

About 5-(methylamino)-1-(trifluoromethyl)pyridin-2-one

5-(methylamino)-1-(trifluoromethyl)pyridin-2-one (PubChem CID 123383374) has the molecular formula C7H7F3N2O and a molecular weight of 192.14 g/mol. Its IUPAC name is 5-(methylamino)-1-(trifluoromethyl)pyridin-2-one.

Molecular Properties

Compound Name5-(methylamino)-1-(trifluoromethyl)pyridin-2-one
PubChem CID123383374
Molecular FormulaC7H7F3N2O
Molecular Weight192.14 g/mol
Exact Mass192.05
IUPAC Name5-(methylamino)-1-(trifluoromethyl)pyridin-2-one
SMILESCNc1ccc(=O)n(C(F)(F)F)c1
InChIInChI=1S/C7H7F3N2O/c1-11-5-2-3-6(13)12(4-5)7(8,9)10/h2-4,11H,1H3
InChIKeyRESSBKXHPAIURJ-UHFFFAOYSA-N
XLogP1.37
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.14
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(methylamino)-1-(trifluoromethyl)pyridin-2-one?
The IUPAC name of 5-(methylamino)-1-(trifluoromethyl)pyridin-2-one (CID 123383374) is 5-(methylamino)-1-(trifluoromethyl)pyridin-2-one.
What is the SMILES notation for 5-(methylamino)-1-(trifluoromethyl)pyridin-2-one?
The canonical SMILES for 5-(methylamino)-1-(trifluoromethyl)pyridin-2-one is CNc1ccc(=O)n(C(F)(F)F)c1.
What is the InChIKey of 5-(methylamino)-1-(trifluoromethyl)pyridin-2-one?
The InChIKey is RESSBKXHPAIURJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7F3N2O/c1-11-5-2-3-6(13)12(4-5)7(8,9)10/h2-4,11H,1H3.
What are the key properties of 5-(methylamino)-1-(trifluoromethyl)pyridin-2-one?
5-(methylamino)-1-(trifluoromethyl)pyridin-2-one has a molecular weight of 192.14 g/mol, XLogP of 1.37, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(methylamino)-1-(trifluoromethyl)pyridin-2-one is sourced from PubChem (CID 123383374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).