N-[2-methoxy-5-(trifluoromethyl)-3-pyridinyl]propanamide

C10H11F3N2O2 — CID 2727249

IUPACN-[2-methoxy-5-(trifluoromethyl)-3-pyridinyl]propanamide
SMILESCCC(=O)Nc1cc(C(F)(F)F)cnc1OC
InChIInChI=1S/C10H11F3N2O2/c1-3-8(16)15-7-4-6(10(11,12)13)5-14-9(7)17-2/h4-5H,3H2,1-2H3,(H,15,16)
InChIKeyOLWMEVJOWCPYJE-UHFFFAOYSA-N
MW248.20 g/mol
LogP2.46
Rot. Bonds3

About N-[2-methoxy-5-(trifluoromethyl)-3-pyridinyl]propanamide

N-[2-methoxy-5-(trifluoromethyl)-3-pyridinyl]propanamide (PubChem CID 2727249) has the molecular formula C10H11F3N2O2 and a molecular weight of 248.20 g/mol. Its IUPAC name is N-[2-methoxy-5-(trifluoromethyl)-3-pyridinyl]propanamide.

Molecular Properties

Compound NameN-[2-methoxy-5-(trifluoromethyl)-3-pyridinyl]propanamide
PubChem CID2727249
Molecular FormulaC10H11F3N2O2
Molecular Weight248.20 g/mol
Exact Mass248.08
IUPAC NameN-[2-methoxy-5-(trifluoromethyl)-3-pyridinyl]propanamide
SMILESCCC(=O)Nc1cc(C(F)(F)F)cnc1OC
InChIInChI=1S/C10H11F3N2O2/c1-3-8(16)15-7-4-6(10(11,12)13)5-14-9(7)17-2/h4-5H,3H2,1-2H3,(H,15,16)
InChIKeyOLWMEVJOWCPYJE-UHFFFAOYSA-N
XLogP2.46
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.20
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[2-methoxy-5-(trifluoromethyl)-3-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 N-[2-methoxy-5-(trifluoromethyl)-3-pyridinyl]propanamide?
The IUPAC name of N-[2-methoxy-5-(trifluoromethyl)-3-pyridinyl]propanamide (CID 2727249) is N-[2-methoxy-5-(trifluoromethyl)-3-pyridinyl]propanamide.
What is the SMILES notation for N-[2-methoxy-5-(trifluoromethyl)-3-pyridinyl]propanamide?
The canonical SMILES for N-[2-methoxy-5-(trifluoromethyl)-3-pyridinyl]propanamide is CCC(=O)Nc1cc(C(F)(F)F)cnc1OC.
What is the InChIKey of N-[2-methoxy-5-(trifluoromethyl)-3-pyridinyl]propanamide?
The InChIKey is OLWMEVJOWCPYJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F3N2O2/c1-3-8(16)15-7-4-6(10(11,12)13)5-14-9(7)17-2/h4-5H,3H2,1-2H3,(H,15,16).
What are the key properties of N-[2-methoxy-5-(trifluoromethyl)-3-pyridinyl]propanamide?
N-[2-methoxy-5-(trifluoromethyl)-3-pyridinyl]propanamide has a molecular weight of 248.20 g/mol, XLogP of 2.46, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methoxy-5-(trifluoromethyl)-3-pyridinyl]propanamide is sourced from PubChem (CID 2727249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).