N-[4-(3-fluorophenoxy)phenyl]piperidine-3-carboxamide;hydrochloride

C18H20ClFN2O2 — CID 119299176

IUPACN-[4-(3-fluorophenoxy)phenyl]piperidine-3-carboxamide;hydrochloride
SMILESCl.O=C(Nc1ccc(Oc2cccc(F)c2)cc1)C1CCCNC1
InChIInChI=1S/C18H19FN2O2.ClH/c19-14-4-1-5-17(11-14)23-16-8-6-15(7-9-16)21-18(22)13-3-2-10-20-12-13;/h1,4-9,11,13,20H,2-3,10,12H2,(H,21,22);1H
InChIKeyHNOQTAPMSOAGGZ-UHFFFAOYSA-N
MW350.82 g/mol
LogP3.98
Rot. Bonds4

About N-[4-(3-fluorophenoxy)phenyl]piperidine-3-carboxamide;hydrochloride

N-[4-(3-fluorophenoxy)phenyl]piperidine-3-carboxamide;hydrochloride (PubChem CID 119299176) has the molecular formula C18H20ClFN2O2 and a molecular weight of 350.82 g/mol. Its IUPAC name is N-[4-(3-fluorophenoxy)phenyl]piperidine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[4-(3-fluorophenoxy)phenyl]piperidine-3-carboxamide;hydrochloride
PubChem CID119299176
Molecular FormulaC18H20ClFN2O2
Molecular Weight350.82 g/mol
Exact Mass350.12
IUPAC NameN-[4-(3-fluorophenoxy)phenyl]piperidine-3-carboxamide;hydrochloride
SMILESCl.O=C(Nc1ccc(Oc2cccc(F)c2)cc1)C1CCCNC1
InChIInChI=1S/C18H19FN2O2.ClH/c19-14-4-1-5-17(11-14)23-16-8-6-15(7-9-16)21-18(22)13-3-2-10-20-12-13;/h1,4-9,11,13,20H,2-3,10,12H2,(H,21,22);1H
InChIKeyHNOQTAPMSOAGGZ-UHFFFAOYSA-N
XLogP3.98
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.82
LogP ≤ 53.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(3-fluorophenoxy)phenyl]piperidine-4-carboxamide;hydrochloride
CID 119299172
(3R)-N-[4-(3-methoxyphenoxy)phenyl]pyrrolidine-3-carboxamide
CID 124687466
(3R)-N-[4-(difluoromethoxy)phenyl]piperidine-3-carboxamide
CID 81123871
N-[3-(2,2,2-trifluoroethoxy)phenyl]piperidine-3-carboxamide;hydrochloride
CID 119291452
N-[4-[(2-fluorophenyl)methoxy]phenyl]piperidine-3-carboxamide
CID 119311313
N-[4-(3-fluorophenoxy)phenyl]-1-(4-fluorophenyl)sulfonylpiperidine-4-carboxamide
CID 55907296
N-[2-(3-fluoroanilino)-2-oxoethyl]piperidine-3-carboxamide;hydrochloride
CID 119308754
N-[4-(3-methylphenoxy)phenyl]piperidine-4-carboxamide
CID 119266283
N-(3-bromo-4-fluorophenyl)piperidine-3-carboxamide;hydrochloride
CID 119281108
N-(3-iodophenyl)piperidine-3-carboxamide;hydrochloride
CID 119263523
N-(3-prop-2-enoxyphenyl)piperidine-3-carboxamide;hydrochloride
CID 119303125
N-[6-(3-ethylphenoxy)-3-pyridinyl]piperidine-3-carboxamide;dihydrochloride
CID 119858521

Frequently Asked Questions

What is the IUPAC name of N-[4-(3-fluorophenoxy)phenyl]piperidine-3-carboxamide;hydrochloride?
The IUPAC name of N-[4-(3-fluorophenoxy)phenyl]piperidine-3-carboxamide;hydrochloride (CID 119299176) is N-[4-(3-fluorophenoxy)phenyl]piperidine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-[4-(3-fluorophenoxy)phenyl]piperidine-3-carboxamide;hydrochloride?
The canonical SMILES for N-[4-(3-fluorophenoxy)phenyl]piperidine-3-carboxamide;hydrochloride is Cl.O=C(Nc1ccc(Oc2cccc(F)c2)cc1)C1CCCNC1.
What is the InChIKey of N-[4-(3-fluorophenoxy)phenyl]piperidine-3-carboxamide;hydrochloride?
The InChIKey is HNOQTAPMSOAGGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN2O2.ClH/c19-14-4-1-5-17(11-14)23-16-8-6-15(7-9-16)21-18(22)13-3-2-10-20-12-13;/h1,4-9,11,13,20H,2-3,10,12H2,(H,21,22);1H.
What are the key properties of N-[4-(3-fluorophenoxy)phenyl]piperidine-3-carboxamide;hydrochloride?
N-[4-(3-fluorophenoxy)phenyl]piperidine-3-carboxamide;hydrochloride has a molecular weight of 350.82 g/mol, XLogP of 3.98, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(3-fluorophenoxy)phenyl]piperidine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119299176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).