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

C11H11F3N2O2 — CID 47137212

IUPAC2-methyl-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]cyclopropane-1-carboxamide
SMILESCC1CC1C(=O)Nc1cc(C(F)(F)F)c[nH]c1=O
InChIInChI=1S/C11H11F3N2O2/c1-5-2-7(5)9(17)16-8-3-6(11(12,13)14)4-15-10(8)18/h3-5,7H,2H2,1H3,(H,15,18)(H,16,17)
InChIKeyXNRSIPHSDHHMGZ-UHFFFAOYSA-N
MW260.21 g/mol
LogP1.99
Rot. Bonds2

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

2-methyl-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]cyclopropane-1-carboxamide (PubChem CID 47137212) has the molecular formula C11H11F3N2O2 and a molecular weight of 260.21 g/mol. Its IUPAC name is 2-methyl-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]cyclopropane-1-carboxamide.

Molecular Properties

Compound Name2-methyl-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]cyclopropane-1-carboxamide
PubChem CID47137212
Molecular FormulaC11H11F3N2O2
Molecular Weight260.21 g/mol
Exact Mass260.08
IUPAC Name2-methyl-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]cyclopropane-1-carboxamide
SMILESCC1CC1C(=O)Nc1cc(C(F)(F)F)c[nH]c1=O
InChIInChI=1S/C11H11F3N2O2/c1-5-2-7(5)9(17)16-8-3-6(11(12,13)14)4-15-10(8)18/h3-5,7H,2H2,1H3,(H,15,18)(H,16,17)
InChIKeyXNRSIPHSDHHMGZ-UHFFFAOYSA-N
XLogP1.99
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.21
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-methylpropyl)-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]piperidine-4-carboxamide
CID 53506463
N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]piperidine-2-carboxamide
CID 72046367
N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]piperidine-3-carboxamide
CID 72046368
N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]piperidine-4-carboxamide
CID 72046372
N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]pyrrolidine-2-carboxamide
CID 72050188
N'-(dicyclopropylmethyl)-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]oxamide
CID 53550143
N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]piperidine-2-carboxamide;hydrochloride
CID 72046366
4-amino-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]butanamide
CID 72046369
1-acetyl-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]piperidine-4-carboxamide
CID 72050206
(2S)-2-acetamido-3-methyl-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]butanamide
CID 94026741
2-[(3S)-3-methylpiperidin-1-yl]-2-oxo-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]acetamide
CID 95328319
2-[3-amino-2-oxo-5-(trifluoromethyl)pyridin-1-yl]-N-(2-ethylbutyl)acetamide
CID 135186733

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]cyclopropane-1-carboxamide?
The IUPAC name of 2-methyl-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]cyclopropane-1-carboxamide (CID 47137212) is 2-methyl-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]cyclopropane-1-carboxamide.
What is the SMILES notation for 2-methyl-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]cyclopropane-1-carboxamide?
The canonical SMILES for 2-methyl-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]cyclopropane-1-carboxamide is CC1CC1C(=O)Nc1cc(C(F)(F)F)c[nH]c1=O.
What is the InChIKey of 2-methyl-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]cyclopropane-1-carboxamide?
The InChIKey is XNRSIPHSDHHMGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11F3N2O2/c1-5-2-7(5)9(17)16-8-3-6(11(12,13)14)4-15-10(8)18/h3-5,7H,2H2,1H3,(H,15,18)(H,16,17).
What are the key properties of 2-methyl-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]cyclopropane-1-carboxamide?
2-methyl-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]cyclopropane-1-carboxamide has a molecular weight of 260.21 g/mol, XLogP of 1.99, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]cyclopropane-1-carboxamide is sourced from PubChem (CID 47137212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).