N-[2-(4-fluorophenyl)ethyl]-2-pyridin-3-yloxyacetamide

C15H15FN2O2 — CID 110487949

IUPACN-[2-(4-fluorophenyl)ethyl]-2-pyridin-3-yloxyacetamide
SMILESO=C(COc1cccnc1)NCCc1ccc(F)cc1
InChIInChI=1S/C15H15FN2O2/c16-13-5-3-12(4-6-13)7-9-18-15(19)11-20-14-2-1-8-17-10-14/h1-6,8,10H,7,9,11H2,(H,18,19)
InChIKeyCZVNZWGXVCBQSA-UHFFFAOYSA-N
MW274.30 g/mol
LogP1.96
Rot. Bonds6

About N-[2-(4-fluorophenyl)ethyl]-2-pyridin-3-yloxyacetamide

N-[2-(4-fluorophenyl)ethyl]-2-pyridin-3-yloxyacetamide (PubChem CID 110487949) has the molecular formula C15H15FN2O2 and a molecular weight of 274.30 g/mol. Its IUPAC name is N-[2-(4-fluorophenyl)ethyl]-2-pyridin-3-yloxyacetamide.

Molecular Properties

Compound NameN-[2-(4-fluorophenyl)ethyl]-2-pyridin-3-yloxyacetamide
PubChem CID110487949
Molecular FormulaC15H15FN2O2
Molecular Weight274.30 g/mol
Exact Mass274.11
IUPAC NameN-[2-(4-fluorophenyl)ethyl]-2-pyridin-3-yloxyacetamide
SMILESO=C(COc1cccnc1)NCCc1ccc(F)cc1
InChIInChI=1S/C15H15FN2O2/c16-13-5-3-12(4-6-13)7-9-18-15(19)11-20-14-2-1-8-17-10-14/h1-6,8,10H,7,9,11H2,(H,18,19)
InChIKeyCZVNZWGXVCBQSA-UHFFFAOYSA-N
XLogP1.96
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.30
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(4-fluorophenyl)ethyl]-2-pyridin-3-yloxyacetamide?
The IUPAC name of N-[2-(4-fluorophenyl)ethyl]-2-pyridin-3-yloxyacetamide (CID 110487949) is N-[2-(4-fluorophenyl)ethyl]-2-pyridin-3-yloxyacetamide.
What is the SMILES notation for N-[2-(4-fluorophenyl)ethyl]-2-pyridin-3-yloxyacetamide?
The canonical SMILES for N-[2-(4-fluorophenyl)ethyl]-2-pyridin-3-yloxyacetamide is O=C(COc1cccnc1)NCCc1ccc(F)cc1.
What is the InChIKey of N-[2-(4-fluorophenyl)ethyl]-2-pyridin-3-yloxyacetamide?
The InChIKey is CZVNZWGXVCBQSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN2O2/c16-13-5-3-12(4-6-13)7-9-18-15(19)11-20-14-2-1-8-17-10-14/h1-6,8,10H,7,9,11H2,(H,18,19).
What are the key properties of N-[2-(4-fluorophenyl)ethyl]-2-pyridin-3-yloxyacetamide?
N-[2-(4-fluorophenyl)ethyl]-2-pyridin-3-yloxyacetamide has a molecular weight of 274.30 g/mol, XLogP of 1.96, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-fluorophenyl)ethyl]-2-pyridin-3-yloxyacetamide is sourced from PubChem (CID 110487949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).