6-(methylamino)-4-(trifluoromethyl)-1H-pyridin-2-one

C7H7F3N2O — CID 102719756

IUPAC6-(methylamino)-4-(trifluoromethyl)-1H-pyridin-2-one
SMILESCNc1cc(C(F)(F)F)cc(=O)[nH]1
InChIInChI=1S/C7H7F3N2O/c1-11-5-2-4(7(8,9)10)3-6(13)12-5/h2-3H,1H3,(H2,11,12,13)
InChIKeyKULJAGJXSHNHKK-UHFFFAOYSA-N
MW192.14 g/mol
LogP1.44
Rot. Bonds1

About 6-(methylamino)-4-(trifluoromethyl)-1H-pyridin-2-one

6-(methylamino)-4-(trifluoromethyl)-1H-pyridin-2-one (PubChem CID 102719756) has the molecular formula C7H7F3N2O and a molecular weight of 192.14 g/mol. Its IUPAC name is 6-(methylamino)-4-(trifluoromethyl)-1H-pyridin-2-one.

Molecular Properties

Compound Name6-(methylamino)-4-(trifluoromethyl)-1H-pyridin-2-one
PubChem CID102719756
Molecular FormulaC7H7F3N2O
Molecular Weight192.14 g/mol
Exact Mass192.05
IUPAC Name6-(methylamino)-4-(trifluoromethyl)-1H-pyridin-2-one
SMILESCNc1cc(C(F)(F)F)cc(=O)[nH]1
InChIInChI=1S/C7H7F3N2O/c1-11-5-2-4(7(8,9)10)3-6(13)12-5/h2-3H,1H3,(H2,11,12,13)
InChIKeyKULJAGJXSHNHKK-UHFFFAOYSA-N
XLogP1.44
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.14
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-(methylamino)-4-(trifluoromethyl)-1H-pyridin-2-one?
The IUPAC name of 6-(methylamino)-4-(trifluoromethyl)-1H-pyridin-2-one (CID 102719756) is 6-(methylamino)-4-(trifluoromethyl)-1H-pyridin-2-one.
What is the SMILES notation for 6-(methylamino)-4-(trifluoromethyl)-1H-pyridin-2-one?
The canonical SMILES for 6-(methylamino)-4-(trifluoromethyl)-1H-pyridin-2-one is CNc1cc(C(F)(F)F)cc(=O)[nH]1.
What is the InChIKey of 6-(methylamino)-4-(trifluoromethyl)-1H-pyridin-2-one?
The InChIKey is KULJAGJXSHNHKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7F3N2O/c1-11-5-2-4(7(8,9)10)3-6(13)12-5/h2-3H,1H3,(H2,11,12,13).
What are the key properties of 6-(methylamino)-4-(trifluoromethyl)-1H-pyridin-2-one?
6-(methylamino)-4-(trifluoromethyl)-1H-pyridin-2-one has a molecular weight of 192.14 g/mol, XLogP of 1.44, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(methylamino)-4-(trifluoromethyl)-1H-pyridin-2-one is sourced from PubChem (CID 102719756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).