N-(2-methoxyethyl)-N-methyl-4-[4-(trifluoromethyl)-2-pyridinyl]benzamide

C17H17F3N2O2 — CID 119075124

IUPACN-(2-methoxyethyl)-N-methyl-4-[4-(trifluoromethyl)-2-pyridinyl]benzamide
SMILESCOCCN(C)C(=O)c1ccc(-c2cc(C(F)(F)F)ccn2)cc1
InChIInChI=1S/C17H17F3N2O2/c1-22(9-10-24-2)16(23)13-5-3-12(4-6-13)15-11-14(7-8-21-15)17(18,19)20/h3-8,11H,9-10H2,1-2H3
InChIKeyLZFXUZDXALVSQX-UHFFFAOYSA-N
MW338.33 g/mol
LogP3.49
Rot. Bonds5

About N-(2-methoxyethyl)-N-methyl-4-[4-(trifluoromethyl)-2-pyridinyl]benzamide

N-(2-methoxyethyl)-N-methyl-4-[4-(trifluoromethyl)-2-pyridinyl]benzamide (PubChem CID 119075124) has the molecular formula C17H17F3N2O2 and a molecular weight of 338.33 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-methyl-4-[4-(trifluoromethyl)-2-pyridinyl]benzamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-methyl-4-[4-(trifluoromethyl)-2-pyridinyl]benzamide
PubChem CID119075124
Molecular FormulaC17H17F3N2O2
Molecular Weight338.33 g/mol
Exact Mass338.12
IUPAC NameN-(2-methoxyethyl)-N-methyl-4-[4-(trifluoromethyl)-2-pyridinyl]benzamide
SMILESCOCCN(C)C(=O)c1ccc(-c2cc(C(F)(F)F)ccn2)cc1
InChIInChI=1S/C17H17F3N2O2/c1-22(9-10-24-2)16(23)13-5-3-12(4-6-13)15-11-14(7-8-21-15)17(18,19)20/h3-8,11H,9-10H2,1-2H3
InChIKeyLZFXUZDXALVSQX-UHFFFAOYSA-N
XLogP3.49
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.33
LogP ≤ 53.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-methyl-4-[4-(trifluoromethyl)-2-pyridinyl]benzamide?
The IUPAC name of N-(2-methoxyethyl)-N-methyl-4-[4-(trifluoromethyl)-2-pyridinyl]benzamide (CID 119075124) is N-(2-methoxyethyl)-N-methyl-4-[4-(trifluoromethyl)-2-pyridinyl]benzamide.
What is the SMILES notation for N-(2-methoxyethyl)-N-methyl-4-[4-(trifluoromethyl)-2-pyridinyl]benzamide?
The canonical SMILES for N-(2-methoxyethyl)-N-methyl-4-[4-(trifluoromethyl)-2-pyridinyl]benzamide is COCCN(C)C(=O)c1ccc(-c2cc(C(F)(F)F)ccn2)cc1.
What is the InChIKey of N-(2-methoxyethyl)-N-methyl-4-[4-(trifluoromethyl)-2-pyridinyl]benzamide?
The InChIKey is LZFXUZDXALVSQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17F3N2O2/c1-22(9-10-24-2)16(23)13-5-3-12(4-6-13)15-11-14(7-8-21-15)17(18,19)20/h3-8,11H,9-10H2,1-2H3.
What are the key properties of N-(2-methoxyethyl)-N-methyl-4-[4-(trifluoromethyl)-2-pyridinyl]benzamide?
N-(2-methoxyethyl)-N-methyl-4-[4-(trifluoromethyl)-2-pyridinyl]benzamide has a molecular weight of 338.33 g/mol, XLogP of 3.49, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-methyl-4-[4-(trifluoromethyl)-2-pyridinyl]benzamide is sourced from PubChem (CID 119075124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).