N-(1-benzylpiperidin-4-yl)-2-(2-fluorophenoxy)acetamide;hydrochloride

C20H24ClFN2O2 — CID 11834429

IUPACN-(1-benzylpiperidin-4-yl)-2-(2-fluorophenoxy)acetamide;hydrochloride
SMILESCl.O=C(COc1ccccc1F)NC1CCN(Cc2ccccc2)CC1
InChIInChI=1S/C20H23FN2O2.ClH/c21-18-8-4-5-9-19(18)25-15-20(24)22-17-10-12-23(13-11-17)14-16-6-2-1-3-7-16;/h1-9,17H,10-15H2,(H,22,24);1H
InChIKeyHRFMALWSPSTYQI-UHFFFAOYSA-N
MW378.88 g/mol
LogP3.41
Rot. Bonds6

About N-(1-benzylpiperidin-4-yl)-2-(2-fluorophenoxy)acetamide;hydrochloride

N-(1-benzylpiperidin-4-yl)-2-(2-fluorophenoxy)acetamide;hydrochloride (PubChem CID 11834429) has the molecular formula C20H24ClFN2O2 and a molecular weight of 378.88 g/mol. Its IUPAC name is N-(1-benzylpiperidin-4-yl)-2-(2-fluorophenoxy)acetamide;hydrochloride.

Molecular Properties

Compound NameN-(1-benzylpiperidin-4-yl)-2-(2-fluorophenoxy)acetamide;hydrochloride
PubChem CID11834429
Molecular FormulaC20H24ClFN2O2
Molecular Weight378.88 g/mol
Exact Mass378.15
IUPAC NameN-(1-benzylpiperidin-4-yl)-2-(2-fluorophenoxy)acetamide;hydrochloride
SMILESCl.O=C(COc1ccccc1F)NC1CCN(Cc2ccccc2)CC1
InChIInChI=1S/C20H23FN2O2.ClH/c21-18-8-4-5-9-19(18)25-15-20(24)22-17-10-12-23(13-11-17)14-16-6-2-1-3-7-16;/h1-9,17H,10-15H2,(H,22,24);1H
InChIKeyHRFMALWSPSTYQI-UHFFFAOYSA-N
XLogP3.41
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.88
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-benzylpiperidin-4-yl)-2-(2-fluorophenoxy)acetamide;hydrochloride?
The IUPAC name of N-(1-benzylpiperidin-4-yl)-2-(2-fluorophenoxy)acetamide;hydrochloride (CID 11834429) is N-(1-benzylpiperidin-4-yl)-2-(2-fluorophenoxy)acetamide;hydrochloride.
What is the SMILES notation for N-(1-benzylpiperidin-4-yl)-2-(2-fluorophenoxy)acetamide;hydrochloride?
The canonical SMILES for N-(1-benzylpiperidin-4-yl)-2-(2-fluorophenoxy)acetamide;hydrochloride is Cl.O=C(COc1ccccc1F)NC1CCN(Cc2ccccc2)CC1.
What is the InChIKey of N-(1-benzylpiperidin-4-yl)-2-(2-fluorophenoxy)acetamide;hydrochloride?
The InChIKey is HRFMALWSPSTYQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23FN2O2.ClH/c21-18-8-4-5-9-19(18)25-15-20(24)22-17-10-12-23(13-11-17)14-16-6-2-1-3-7-16;/h1-9,17H,10-15H2,(H,22,24);1H.
What are the key properties of N-(1-benzylpiperidin-4-yl)-2-(2-fluorophenoxy)acetamide;hydrochloride?
N-(1-benzylpiperidin-4-yl)-2-(2-fluorophenoxy)acetamide;hydrochloride has a molecular weight of 378.88 g/mol, XLogP of 3.41, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzylpiperidin-4-yl)-2-(2-fluorophenoxy)acetamide;hydrochloride is sourced from PubChem (CID 11834429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).