2-(2-fluorophenoxy)-N-(2-piperidin-1-ylethyl)propanamide

C16H23FN2O2 — CID 2935429

IUPAC2-(2-fluorophenoxy)-N-(2-piperidin-1-ylethyl)propanamide
SMILESCC(Oc1ccccc1F)C(=O)NCCN1CCCCC1
InChIInChI=1S/C16H23FN2O2/c1-13(21-15-8-4-3-7-14(15)17)16(20)18-9-12-19-10-5-2-6-11-19/h3-4,7-8,13H,2,5-6,9-12H2,1H3,(H,18,20)
InChIKeyCEFVRDMSCMIZGZ-UHFFFAOYSA-N
MW294.37 g/mol
LogP2.20
Rot. Bonds6

About 2-(2-fluorophenoxy)-N-(2-piperidin-1-ylethyl)propanamide

2-(2-fluorophenoxy)-N-(2-piperidin-1-ylethyl)propanamide (PubChem CID 2935429) has the molecular formula C16H23FN2O2 and a molecular weight of 294.37 g/mol. Its IUPAC name is 2-(2-fluorophenoxy)-N-(2-piperidin-1-ylethyl)propanamide.

Molecular Properties

Compound Name2-(2-fluorophenoxy)-N-(2-piperidin-1-ylethyl)propanamide
PubChem CID2935429
Molecular FormulaC16H23FN2O2
Molecular Weight294.37 g/mol
Exact Mass294.17
IUPAC Name2-(2-fluorophenoxy)-N-(2-piperidin-1-ylethyl)propanamide
SMILESCC(Oc1ccccc1F)C(=O)NCCN1CCCCC1
InChIInChI=1S/C16H23FN2O2/c1-13(21-15-8-4-3-7-14(15)17)16(20)18-9-12-19-10-5-2-6-11-19/h3-4,7-8,13H,2,5-6,9-12H2,1H3,(H,18,20)
InChIKeyCEFVRDMSCMIZGZ-UHFFFAOYSA-N
XLogP2.20
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.37
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenoxy)-N-(2-piperidin-1-ylethyl)propanamide?
The IUPAC name of 2-(2-fluorophenoxy)-N-(2-piperidin-1-ylethyl)propanamide (CID 2935429) is 2-(2-fluorophenoxy)-N-(2-piperidin-1-ylethyl)propanamide.
What is the SMILES notation for 2-(2-fluorophenoxy)-N-(2-piperidin-1-ylethyl)propanamide?
The canonical SMILES for 2-(2-fluorophenoxy)-N-(2-piperidin-1-ylethyl)propanamide is CC(Oc1ccccc1F)C(=O)NCCN1CCCCC1.
What is the InChIKey of 2-(2-fluorophenoxy)-N-(2-piperidin-1-ylethyl)propanamide?
The InChIKey is CEFVRDMSCMIZGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23FN2O2/c1-13(21-15-8-4-3-7-14(15)17)16(20)18-9-12-19-10-5-2-6-11-19/h3-4,7-8,13H,2,5-6,9-12H2,1H3,(H,18,20).
What are the key properties of 2-(2-fluorophenoxy)-N-(2-piperidin-1-ylethyl)propanamide?
2-(2-fluorophenoxy)-N-(2-piperidin-1-ylethyl)propanamide has a molecular weight of 294.37 g/mol, XLogP of 2.20, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenoxy)-N-(2-piperidin-1-ylethyl)propanamide is sourced from PubChem (CID 2935429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).