N-methyl-2-[2-methyl-6-oxo-4-(trifluoromethyl)-1-pyridinyl]-N-propan-2-ylacetamide

C13H17F3N2O2 — CID 72880975

IUPACN-methyl-2-[2-methyl-6-oxo-4-(trifluoromethyl)-1-pyridinyl]-N-propan-2-ylacetamide
SMILESCc1cc(C(F)(F)F)cc(=O)n1CC(=O)N(C)C(C)C
InChIInChI=1S/C13H17F3N2O2/c1-8(2)17(4)12(20)7-18-9(3)5-10(6-11(18)19)13(14,15)16/h5-6,8H,7H2,1-4H3
InChIKeyWXKRYDGPFRXYCG-UHFFFAOYSA-N
MW290.29 g/mol
LogP2.04
Rot. Bonds3

About N-methyl-2-[2-methyl-6-oxo-4-(trifluoromethyl)-1-pyridinyl]-N-propan-2-ylacetamide

N-methyl-2-[2-methyl-6-oxo-4-(trifluoromethyl)-1-pyridinyl]-N-propan-2-ylacetamide (PubChem CID 72880975) has the molecular formula C13H17F3N2O2 and a molecular weight of 290.29 g/mol. Its IUPAC name is N-methyl-2-[2-methyl-6-oxo-4-(trifluoromethyl)-1-pyridinyl]-N-propan-2-ylacetamide.

Molecular Properties

Compound NameN-methyl-2-[2-methyl-6-oxo-4-(trifluoromethyl)-1-pyridinyl]-N-propan-2-ylacetamide
PubChem CID72880975
Molecular FormulaC13H17F3N2O2
Molecular Weight290.29 g/mol
Exact Mass290.12
IUPAC NameN-methyl-2-[2-methyl-6-oxo-4-(trifluoromethyl)-1-pyridinyl]-N-propan-2-ylacetamide
SMILESCc1cc(C(F)(F)F)cc(=O)n1CC(=O)N(C)C(C)C
InChIInChI=1S/C13H17F3N2O2/c1-8(2)17(4)12(20)7-18-9(3)5-10(6-11(18)19)13(14,15)16/h5-6,8H,7H2,1-4H3
InChIKeyWXKRYDGPFRXYCG-UHFFFAOYSA-N
XLogP2.04
TPSA42.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.29
LogP ≤ 52.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(cyclopenten-1-yl)-N-ethyl-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide
CID 8894038
2-[acetyl(methyl)amino]-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]acetamide
CID 47249058
1,6-Dimethyl-4-(trifluoromethyl)pyridin-2(1H)-one
CID 22382014
1,4-dimethyl-6-(trifluoromethyl)-1H-pyridin-2-one
CID 22382050
2-[6-oxo-8-(trifluoromethyl)-3,4-dihydro-1H-pyrido[1,2-a]pyrazin-2-yl]acetamide
CID 71192986
3-Amino-1-ethyl-5-(trifluoromethyl)pyridin-2-one
CID 84008555
[1-Ethyl-2-oxo-5-(trifluoromethyl)-3-pyridinyl]urea
CID 141393615
2,2,2-trifluoro-N-(5-methyl-2-oxo-1H-pyridin-3-yl)acetamide
CID 158699580
1-[(3S)-6-(difluoromethyl)-1-methyl-2-oxo-3,4-dihydropyridin-3-yl]-3-ethenyl-4-methylpyrrole-2,5-dione
CID 163701652
3-Isothiocyanato-1-propan-2-yl-5-(trifluoromethyl)pyridin-2-one
CID 164558654
3-Amino-1-propan-2-yl-5-(trifluoromethyl)pyridin-2-one
CID 164559844
1-Propan-2-yl-4,6-bis(trifluoromethyl)pyridin-2-one
CID 170587584

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[2-methyl-6-oxo-4-(trifluoromethyl)-1-pyridinyl]-N-propan-2-ylacetamide?
The IUPAC name of N-methyl-2-[2-methyl-6-oxo-4-(trifluoromethyl)-1-pyridinyl]-N-propan-2-ylacetamide (CID 72880975) is N-methyl-2-[2-methyl-6-oxo-4-(trifluoromethyl)-1-pyridinyl]-N-propan-2-ylacetamide.
What is the SMILES notation for N-methyl-2-[2-methyl-6-oxo-4-(trifluoromethyl)-1-pyridinyl]-N-propan-2-ylacetamide?
The canonical SMILES for N-methyl-2-[2-methyl-6-oxo-4-(trifluoromethyl)-1-pyridinyl]-N-propan-2-ylacetamide is Cc1cc(C(F)(F)F)cc(=O)n1CC(=O)N(C)C(C)C.
What is the InChIKey of N-methyl-2-[2-methyl-6-oxo-4-(trifluoromethyl)-1-pyridinyl]-N-propan-2-ylacetamide?
The InChIKey is WXKRYDGPFRXYCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17F3N2O2/c1-8(2)17(4)12(20)7-18-9(3)5-10(6-11(18)19)13(14,15)16/h5-6,8H,7H2,1-4H3.
What are the key properties of N-methyl-2-[2-methyl-6-oxo-4-(trifluoromethyl)-1-pyridinyl]-N-propan-2-ylacetamide?
N-methyl-2-[2-methyl-6-oxo-4-(trifluoromethyl)-1-pyridinyl]-N-propan-2-ylacetamide has a molecular weight of 290.29 g/mol, XLogP of 2.04, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[2-methyl-6-oxo-4-(trifluoromethyl)-1-pyridinyl]-N-propan-2-ylacetamide is sourced from PubChem (CID 72880975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).