2-(oxolan-2-ylmethoxy)-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide

C14H17F3N2O3 — CID 56823133

IUPAC2-(oxolan-2-ylmethoxy)-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide
SMILESCC(OCC1CCCO1)C(=O)Nc1cccc(C(F)(F)F)n1
InChIInChI=1S/C14H17F3N2O3/c1-9(22-8-10-4-3-7-21-10)13(20)19-12-6-2-5-11(18-12)14(15,16)17/h2,5-6,9-10H,3-4,7-8H2,1H3,(H,18,19,20)
InChIKeyBOHWYFZJZZRJBY-UHFFFAOYSA-N
MW318.29 g/mol
LogP2.62
Rot. Bonds5

About 2-(oxolan-2-ylmethoxy)-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide

2-(oxolan-2-ylmethoxy)-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide (PubChem CID 56823133) has the molecular formula C14H17F3N2O3 and a molecular weight of 318.29 g/mol. Its IUPAC name is 2-(oxolan-2-ylmethoxy)-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide.

Molecular Properties

Compound Name2-(oxolan-2-ylmethoxy)-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide
PubChem CID56823133
Molecular FormulaC14H17F3N2O3
Molecular Weight318.29 g/mol
Exact Mass318.12
IUPAC Name2-(oxolan-2-ylmethoxy)-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide
SMILESCC(OCC1CCCO1)C(=O)Nc1cccc(C(F)(F)F)n1
InChIInChI=1S/C14H17F3N2O3/c1-9(22-8-10-4-3-7-21-10)13(20)19-12-6-2-5-11(18-12)14(15,16)17/h2,5-6,9-10H,3-4,7-8H2,1H3,(H,18,19,20)
InChIKeyBOHWYFZJZZRJBY-UHFFFAOYSA-N
XLogP2.62
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.29
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(oxolan-2-ylmethoxy)-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(oxolan-2-ylmethoxy)-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide?
The IUPAC name of 2-(oxolan-2-ylmethoxy)-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide (CID 56823133) is 2-(oxolan-2-ylmethoxy)-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide.
What is the SMILES notation for 2-(oxolan-2-ylmethoxy)-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide?
The canonical SMILES for 2-(oxolan-2-ylmethoxy)-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide is CC(OCC1CCCO1)C(=O)Nc1cccc(C(F)(F)F)n1.
What is the InChIKey of 2-(oxolan-2-ylmethoxy)-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide?
The InChIKey is BOHWYFZJZZRJBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17F3N2O3/c1-9(22-8-10-4-3-7-21-10)13(20)19-12-6-2-5-11(18-12)14(15,16)17/h2,5-6,9-10H,3-4,7-8H2,1H3,(H,18,19,20).
What are the key properties of 2-(oxolan-2-ylmethoxy)-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide?
2-(oxolan-2-ylmethoxy)-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide has a molecular weight of 318.29 g/mol, XLogP of 2.62, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(oxolan-2-ylmethoxy)-N-[6-(trifluoromethyl)-2-pyridinyl]propanamide is sourced from PubChem (CID 56823133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).