2-methyl-3-(methylamino)-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]propanamide

C11H14F3N3O2 — CID 119399141

IUPAC2-methyl-3-(methylamino)-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]propanamide
SMILESCNCC(C)C(=O)Nc1cc(C(F)(F)F)c[nH]c1=O
InChIInChI=1S/C11H14F3N3O2/c1-6(4-15-2)9(18)17-8-3-7(11(12,13)14)5-16-10(8)19/h3,5-6,15H,4H2,1-2H3,(H,16,19)(H,17,18)
InChIKeyLDPFXPNZRFCXKP-UHFFFAOYSA-N
MW277.25 g/mol
LogP1.19
Rot. Bonds4

About 2-methyl-3-(methylamino)-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]propanamide

2-methyl-3-(methylamino)-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]propanamide (PubChem CID 119399141) has the molecular formula C11H14F3N3O2 and a molecular weight of 277.25 g/mol. Its IUPAC name is 2-methyl-3-(methylamino)-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]propanamide.

Molecular Properties

Compound Name2-methyl-3-(methylamino)-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]propanamide
PubChem CID119399141
Molecular FormulaC11H14F3N3O2
Molecular Weight277.25 g/mol
Exact Mass277.10
IUPAC Name2-methyl-3-(methylamino)-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]propanamide
SMILESCNCC(C)C(=O)Nc1cc(C(F)(F)F)c[nH]c1=O
InChIInChI=1S/C11H14F3N3O2/c1-6(4-15-2)9(18)17-8-3-7(11(12,13)14)5-16-10(8)19/h3,5-6,15H,4H2,1-2H3,(H,16,19)(H,17,18)
InChIKeyLDPFXPNZRFCXKP-UHFFFAOYSA-N
XLogP1.19
TPSA73.99 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.25
LogP ≤ 51.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(methylamino)-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]propanamide?
The IUPAC name of 2-methyl-3-(methylamino)-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]propanamide (CID 119399141) is 2-methyl-3-(methylamino)-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]propanamide.
What is the SMILES notation for 2-methyl-3-(methylamino)-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]propanamide?
The canonical SMILES for 2-methyl-3-(methylamino)-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]propanamide is CNCC(C)C(=O)Nc1cc(C(F)(F)F)c[nH]c1=O.
What is the InChIKey of 2-methyl-3-(methylamino)-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]propanamide?
The InChIKey is LDPFXPNZRFCXKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F3N3O2/c1-6(4-15-2)9(18)17-8-3-7(11(12,13)14)5-16-10(8)19/h3,5-6,15H,4H2,1-2H3,(H,16,19)(H,17,18).
What are the key properties of 2-methyl-3-(methylamino)-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]propanamide?
2-methyl-3-(methylamino)-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]propanamide has a molecular weight of 277.25 g/mol, XLogP of 1.19, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(methylamino)-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]propanamide is sourced from PubChem (CID 119399141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).