2-[4-(trifluoromethoxy)phenyl]-N-(2,4,6-trimethyl-3-pyridinyl)acetamide

C17H17F3N2O2 — CID 78884857

IUPAC2-[4-(trifluoromethoxy)phenyl]-N-(2,4,6-trimethyl-3-pyridinyl)acetamide
SMILESCc1cc(C)c(NC(=O)Cc2ccc(OC(F)(F)F)cc2)c(C)n1
InChIInChI=1S/C17H17F3N2O2/c1-10-8-11(2)21-12(3)16(10)22-15(23)9-13-4-6-14(7-5-13)24-17(18,19)20/h4-8H,9H2,1-3H3,(H,22,23)
InChIKeyMRPCKKLAJVGHAH-UHFFFAOYSA-N
MW338.33 g/mol
LogP4.09
Rot. Bonds4

About 2-[4-(trifluoromethoxy)phenyl]-N-(2,4,6-trimethyl-3-pyridinyl)acetamide

2-[4-(trifluoromethoxy)phenyl]-N-(2,4,6-trimethyl-3-pyridinyl)acetamide (PubChem CID 78884857) has the molecular formula C17H17F3N2O2 and a molecular weight of 338.33 g/mol. Its IUPAC name is 2-[4-(trifluoromethoxy)phenyl]-N-(2,4,6-trimethyl-3-pyridinyl)acetamide.

Molecular Properties

Compound Name2-[4-(trifluoromethoxy)phenyl]-N-(2,4,6-trimethyl-3-pyridinyl)acetamide
PubChem CID78884857
Molecular FormulaC17H17F3N2O2
Molecular Weight338.33 g/mol
Exact Mass338.12
IUPAC Name2-[4-(trifluoromethoxy)phenyl]-N-(2,4,6-trimethyl-3-pyridinyl)acetamide
SMILESCc1cc(C)c(NC(=O)Cc2ccc(OC(F)(F)F)cc2)c(C)n1
InChIInChI=1S/C17H17F3N2O2/c1-10-8-11(2)21-12(3)16(10)22-15(23)9-13-4-6-14(7-5-13)24-17(18,19)20/h4-8H,9H2,1-3H3,(H,22,23)
InChIKeyMRPCKKLAJVGHAH-UHFFFAOYSA-N
XLogP4.09
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.33
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-butylphenyl)-N-(2,4,6-trimethyl-3-pyridinyl)acetamide
CID 78859538
N-(4-methoxyphenyl)-2-[4-(trifluoromethoxy)phenyl]acetamide
CID 46484833
2-(3,4-dimethylphenyl)-N-[[4-(trifluoromethoxy)phenyl]methyl]acetamide
CID 24646594
2-naphthalen-2-yloxy-N-(2,4,6-trimethyl-3-pyridinyl)acetamide
CID 78838178
N-(4-amino-2,6-dimethylphenyl)-2-(4-methoxyphenyl)acetamide
CID 79993432
2-(4-chlorophenyl)-N-[4-(trifluoromethoxy)phenyl]acetamide
CID 2678277
2-[4-(trifluoromethoxy)phenyl]-N-[[4-(trifluoromethoxy)phenyl]methyl]acetamide
CID 112829044
3-(4-chlorophenyl)-N-(2,4,6-trimethyl-3-pyridinyl)propanamide
CID 78837758
N-(1H-pyrazol-4-yl)-2-[4-(trifluoromethoxy)phenyl]acetamide
CID 60506630
2-naphthalen-2-yl-N-[4-(trifluoromethoxy)phenyl]acetamide
CID 18277342
N-[(1R)-1-cyanopropyl]-2-[4-(trifluoromethoxy)phenyl]acetamide
CID 95292371
N-(2-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl)-2-[4-(trifluoromethoxy)phenyl]acetamide
CID 53190349

Frequently Asked Questions

What is the IUPAC name of 2-[4-(trifluoromethoxy)phenyl]-N-(2,4,6-trimethyl-3-pyridinyl)acetamide?
The IUPAC name of 2-[4-(trifluoromethoxy)phenyl]-N-(2,4,6-trimethyl-3-pyridinyl)acetamide (CID 78884857) is 2-[4-(trifluoromethoxy)phenyl]-N-(2,4,6-trimethyl-3-pyridinyl)acetamide.
What is the SMILES notation for 2-[4-(trifluoromethoxy)phenyl]-N-(2,4,6-trimethyl-3-pyridinyl)acetamide?
The canonical SMILES for 2-[4-(trifluoromethoxy)phenyl]-N-(2,4,6-trimethyl-3-pyridinyl)acetamide is Cc1cc(C)c(NC(=O)Cc2ccc(OC(F)(F)F)cc2)c(C)n1.
What is the InChIKey of 2-[4-(trifluoromethoxy)phenyl]-N-(2,4,6-trimethyl-3-pyridinyl)acetamide?
The InChIKey is MRPCKKLAJVGHAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17F3N2O2/c1-10-8-11(2)21-12(3)16(10)22-15(23)9-13-4-6-14(7-5-13)24-17(18,19)20/h4-8H,9H2,1-3H3,(H,22,23).
What are the key properties of 2-[4-(trifluoromethoxy)phenyl]-N-(2,4,6-trimethyl-3-pyridinyl)acetamide?
2-[4-(trifluoromethoxy)phenyl]-N-(2,4,6-trimethyl-3-pyridinyl)acetamide has a molecular weight of 338.33 g/mol, XLogP of 4.09, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(trifluoromethoxy)phenyl]-N-(2,4,6-trimethyl-3-pyridinyl)acetamide is sourced from PubChem (CID 78884857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).