N-(2-methoxyethoxy)-5-(trifluoromethyl)pyridine-2-carboxamide

C10H11F3N2O3 — CID 113249806

IUPACN-(2-methoxyethoxy)-5-(trifluoromethyl)pyridine-2-carboxamide
SMILESCOCCONC(=O)c1ccc(C(F)(F)F)cn1
InChIInChI=1S/C10H11F3N2O3/c1-17-4-5-18-15-9(16)8-3-2-7(6-14-8)10(11,12)13/h2-3,6H,4-5H2,1H3,(H,15,16)
InChIKeyJPQUOFVYPKQWJH-UHFFFAOYSA-N
MW264.20 g/mol
LogP1.41
Rot. Bonds5

About N-(2-methoxyethoxy)-5-(trifluoromethyl)pyridine-2-carboxamide

N-(2-methoxyethoxy)-5-(trifluoromethyl)pyridine-2-carboxamide (PubChem CID 113249806) has the molecular formula C10H11F3N2O3 and a molecular weight of 264.20 g/mol. Its IUPAC name is N-(2-methoxyethoxy)-5-(trifluoromethyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyethoxy)-5-(trifluoromethyl)pyridine-2-carboxamide
PubChem CID113249806
Molecular FormulaC10H11F3N2O3
Molecular Weight264.20 g/mol
Exact Mass264.07
IUPAC NameN-(2-methoxyethoxy)-5-(trifluoromethyl)pyridine-2-carboxamide
SMILESCOCCONC(=O)c1ccc(C(F)(F)F)cn1
InChIInChI=1S/C10H11F3N2O3/c1-17-4-5-18-15-9(16)8-3-2-7(6-14-8)10(11,12)13/h2-3,6H,4-5H2,1H3,(H,15,16)
InChIKeyJPQUOFVYPKQWJH-UHFFFAOYSA-N
XLogP1.41
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.20
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(2-methoxyethyl)-5-(trifluoromethyl)pyridine-2-carboxamide
CID 154762971
4-methoxy-1-[5-(trifluoromethyl)-2-pyridinyl]butan-1-one
CID 105135540
N-(2-chloroethyl)-N-(2-methoxyethyl)-5-(trifluoromethyl)pyridine-2-carboxamide
CID 114909425
ethyl 2-[[5-(trifluoromethyl)pyridine-2-carbonyl]amino]propanoate
CID 115593424
N-(2-chloro-3-methoxypropyl)-N-methyl-5-(trifluoromethyl)pyridine-2-carboxamide
CID 114909335
N-(2-methoxyethoxy)-2-[4-(trifluoromethyl)phenyl]acetamide
CID 79673463
2-fluoro-N-(2-methoxyethoxy)-5-(trifluoromethyl)benzamide
CID 80712032
N-(4-aminobutyl)-5-(trifluoromethyl)pyridine-2-carboxamide
CID 113368697
N-(1-amino-2-methyl-1-sulfanylidenepropan-2-yl)-5-(trifluoromethyl)pyridine-2-carboxamide
CID 114908464
N-[2-(ethylamino)ethyl]-5-(trifluoromethyl)pyridine-2-carboxamide
CID 113265555
N-[4-(aminomethyl)phenyl]-5-(trifluoromethyl)pyridine-2-carboxamide
CID 114750435
5-bromo-N-(2,2,2-trifluoroethoxy)pyridine-2-carboxamide
CID 81343082

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethoxy)-5-(trifluoromethyl)pyridine-2-carboxamide?
The IUPAC name of N-(2-methoxyethoxy)-5-(trifluoromethyl)pyridine-2-carboxamide (CID 113249806) is N-(2-methoxyethoxy)-5-(trifluoromethyl)pyridine-2-carboxamide.
What is the SMILES notation for N-(2-methoxyethoxy)-5-(trifluoromethyl)pyridine-2-carboxamide?
The canonical SMILES for N-(2-methoxyethoxy)-5-(trifluoromethyl)pyridine-2-carboxamide is COCCONC(=O)c1ccc(C(F)(F)F)cn1.
What is the InChIKey of N-(2-methoxyethoxy)-5-(trifluoromethyl)pyridine-2-carboxamide?
The InChIKey is JPQUOFVYPKQWJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F3N2O3/c1-17-4-5-18-15-9(16)8-3-2-7(6-14-8)10(11,12)13/h2-3,6H,4-5H2,1H3,(H,15,16).
What are the key properties of N-(2-methoxyethoxy)-5-(trifluoromethyl)pyridine-2-carboxamide?
N-(2-methoxyethoxy)-5-(trifluoromethyl)pyridine-2-carboxamide has a molecular weight of 264.20 g/mol, XLogP of 1.41, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethoxy)-5-(trifluoromethyl)pyridine-2-carboxamide is sourced from PubChem (CID 113249806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).