N-(4-fluorophenyl)piperidin-1-amine;hydrochloride

C11H16ClFN2 — CID 172725388

IUPACN-(4-fluorophenyl)piperidin-1-amine;hydrochloride
SMILESCl.Fc1ccc(NN2CCCCC2)cc1
InChIInChI=1S/C11H15FN2.ClH/c12-10-4-6-11(7-5-10)13-14-8-2-1-3-9-14;/h4-7,13H,1-3,8-9H2;1H
InChIKeyHBQBBOVWJJTKAG-UHFFFAOYSA-N
MW230.71 g/mol
LogP3.06
Rot. Bonds2

About N-(4-fluorophenyl)piperidin-1-amine;hydrochloride

N-(4-fluorophenyl)piperidin-1-amine;hydrochloride (PubChem CID 172725388) has the molecular formula C11H16ClFN2 and a molecular weight of 230.71 g/mol. Its IUPAC name is N-(4-fluorophenyl)piperidin-1-amine;hydrochloride.

Molecular Properties

Compound NameN-(4-fluorophenyl)piperidin-1-amine;hydrochloride
PubChem CID172725388
Molecular FormulaC11H16ClFN2
Molecular Weight230.71 g/mol
Exact Mass230.10
IUPAC NameN-(4-fluorophenyl)piperidin-1-amine;hydrochloride
SMILESCl.Fc1ccc(NN2CCCCC2)cc1
InChIInChI=1S/C11H15FN2.ClH/c12-10-4-6-11(7-5-10)13-14-8-2-1-3-9-14;/h4-7,13H,1-3,8-9H2;1H
InChIKeyHBQBBOVWJJTKAG-UHFFFAOYSA-N
XLogP3.06
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.71
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)piperidin-1-amine;hydrochloride?
The IUPAC name of N-(4-fluorophenyl)piperidin-1-amine;hydrochloride (CID 172725388) is N-(4-fluorophenyl)piperidin-1-amine;hydrochloride.
What is the SMILES notation for N-(4-fluorophenyl)piperidin-1-amine;hydrochloride?
The canonical SMILES for N-(4-fluorophenyl)piperidin-1-amine;hydrochloride is Cl.Fc1ccc(NN2CCCCC2)cc1.
What is the InChIKey of N-(4-fluorophenyl)piperidin-1-amine;hydrochloride?
The InChIKey is HBQBBOVWJJTKAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15FN2.ClH/c12-10-4-6-11(7-5-10)13-14-8-2-1-3-9-14;/h4-7,13H,1-3,8-9H2;1H.
What are the key properties of N-(4-fluorophenyl)piperidin-1-amine;hydrochloride?
N-(4-fluorophenyl)piperidin-1-amine;hydrochloride has a molecular weight of 230.71 g/mol, XLogP of 3.06, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)piperidin-1-amine;hydrochloride is sourced from PubChem (CID 172725388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).