(4-fluorophenyl)-piperidin-4-ylmethanone;hydrochloride

C12H15ClFNO — CID 3084438

IUPAC(4-fluorophenyl)-piperidin-4-ylmethanone;hydrochloride
SMILESCl.O=C(c1ccc(F)cc1)C1CCNCC1
InChIInChI=1S/C12H14FNO.ClH/c13-11-3-1-9(2-4-11)12(15)10-5-7-14-8-6-10;/h1-4,10,14H,5-8H2;1H
InChIKeyGPKDBZQZPNOBGM-UHFFFAOYSA-N
MW243.71 g/mol
LogP2.43
Rot. Bonds2

About (4-fluorophenyl)-piperidin-4-ylmethanone;hydrochloride

(4-fluorophenyl)-piperidin-4-ylmethanone;hydrochloride (PubChem CID 3084438) has the molecular formula C12H15ClFNO and a molecular weight of 243.71 g/mol. Its IUPAC name is (4-fluorophenyl)-piperidin-4-ylmethanone;hydrochloride.

Molecular Properties

Compound Name(4-fluorophenyl)-piperidin-4-ylmethanone;hydrochloride
PubChem CID3084438
Molecular FormulaC12H15ClFNO
Molecular Weight243.71 g/mol
Exact Mass243.08
IUPAC Name(4-fluorophenyl)-piperidin-4-ylmethanone;hydrochloride
SMILESCl.O=C(c1ccc(F)cc1)C1CCNCC1
InChIInChI=1S/C12H14FNO.ClH/c13-11-3-1-9(2-4-11)12(15)10-5-7-14-8-6-10;/h1-4,10,14H,5-8H2;1H
InChIKeyGPKDBZQZPNOBGM-UHFFFAOYSA-N
XLogP2.43
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.71
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (4-fluorophenyl)-piperidin-4-ylmethanone;hydrochloride 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 (4-fluorophenyl)-piperidin-4-ylmethanone;hydrochloride?
The IUPAC name of (4-fluorophenyl)-piperidin-4-ylmethanone;hydrochloride (CID 3084438) is (4-fluorophenyl)-piperidin-4-ylmethanone;hydrochloride.
What is the SMILES notation for (4-fluorophenyl)-piperidin-4-ylmethanone;hydrochloride?
The canonical SMILES for (4-fluorophenyl)-piperidin-4-ylmethanone;hydrochloride is Cl.O=C(c1ccc(F)cc1)C1CCNCC1.
What is the InChIKey of (4-fluorophenyl)-piperidin-4-ylmethanone;hydrochloride?
The InChIKey is GPKDBZQZPNOBGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14FNO.ClH/c13-11-3-1-9(2-4-11)12(15)10-5-7-14-8-6-10;/h1-4,10,14H,5-8H2;1H.
What are the key properties of (4-fluorophenyl)-piperidin-4-ylmethanone;hydrochloride?
(4-fluorophenyl)-piperidin-4-ylmethanone;hydrochloride has a molecular weight of 243.71 g/mol, XLogP of 2.43, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluorophenyl)-piperidin-4-ylmethanone;hydrochloride is sourced from PubChem (CID 3084438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).