N-[(4-methoxyphenyl)methyl]-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide

C16H15F3N2O3 — CID 2078189

IUPACN-[(4-methoxyphenyl)methyl]-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide
SMILESCOc1ccc(CNC(=O)Cn2cc(C(F)(F)F)ccc2=O)cc1
InChIInChI=1S/C16H15F3N2O3/c1-24-13-5-2-11(3-6-13)8-20-14(22)10-21-9-12(16(17,18)19)4-7-15(21)23/h2-7,9H,8,10H2,1H3,(H,20,22)
InChIKeyFQIJCZVMFMFGEF-UHFFFAOYSA-N
MW340.30 g/mol
LogP2.19
Rot. Bonds5

About N-[(4-methoxyphenyl)methyl]-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide

N-[(4-methoxyphenyl)methyl]-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide (PubChem CID 2078189) has the molecular formula C16H15F3N2O3 and a molecular weight of 340.30 g/mol. Its IUPAC name is N-[(4-methoxyphenyl)methyl]-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide.

Molecular Properties

Compound NameN-[(4-methoxyphenyl)methyl]-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide
PubChem CID2078189
Molecular FormulaC16H15F3N2O3
Molecular Weight340.30 g/mol
Exact Mass340.10
IUPAC NameN-[(4-methoxyphenyl)methyl]-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide
SMILESCOc1ccc(CNC(=O)Cn2cc(C(F)(F)F)ccc2=O)cc1
InChIInChI=1S/C16H15F3N2O3/c1-24-13-5-2-11(3-6-13)8-20-14(22)10-21-9-12(16(17,18)19)4-7-15(21)23/h2-7,9H,8,10H2,1H3,(H,20,22)
InChIKeyFQIJCZVMFMFGEF-UHFFFAOYSA-N
XLogP2.19
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.30
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(4-methoxyphenyl)methyl]-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide?
The IUPAC name of N-[(4-methoxyphenyl)methyl]-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide (CID 2078189) is N-[(4-methoxyphenyl)methyl]-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide.
What is the SMILES notation for N-[(4-methoxyphenyl)methyl]-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide?
The canonical SMILES for N-[(4-methoxyphenyl)methyl]-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide is COc1ccc(CNC(=O)Cn2cc(C(F)(F)F)ccc2=O)cc1.
What is the InChIKey of N-[(4-methoxyphenyl)methyl]-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide?
The InChIKey is FQIJCZVMFMFGEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15F3N2O3/c1-24-13-5-2-11(3-6-13)8-20-14(22)10-21-9-12(16(17,18)19)4-7-15(21)23/h2-7,9H,8,10H2,1H3,(H,20,22).
What are the key properties of N-[(4-methoxyphenyl)methyl]-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide?
N-[(4-methoxyphenyl)methyl]-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide has a molecular weight of 340.30 g/mol, XLogP of 2.19, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methoxyphenyl)methyl]-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide is sourced from PubChem (CID 2078189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).