N-[4-fluoro-2-(4-fluorophenyl)phenyl]piperidine-3-carboxamide

C18H18F2N2O — CID 119316632

IUPACN-[4-fluoro-2-(4-fluorophenyl)phenyl]piperidine-3-carboxamide
SMILESO=C(Nc1ccc(F)cc1-c1ccc(F)cc1)C1CCCNC1
InChIInChI=1S/C18H18F2N2O/c19-14-5-3-12(4-6-14)16-10-15(20)7-8-17(16)22-18(23)13-2-1-9-21-11-13/h3-8,10,13,21H,1-2,9,11H2,(H,22,23)
InChIKeyZZTFCLMCUHAMFX-UHFFFAOYSA-N
MW316.35 g/mol
LogP3.57
Rot. Bonds3

About N-[4-fluoro-2-(4-fluorophenyl)phenyl]piperidine-3-carboxamide

N-[4-fluoro-2-(4-fluorophenyl)phenyl]piperidine-3-carboxamide (PubChem CID 119316632) has the molecular formula C18H18F2N2O and a molecular weight of 316.35 g/mol. Its IUPAC name is N-[4-fluoro-2-(4-fluorophenyl)phenyl]piperidine-3-carboxamide.

Molecular Properties

Compound NameN-[4-fluoro-2-(4-fluorophenyl)phenyl]piperidine-3-carboxamide
PubChem CID119316632
Molecular FormulaC18H18F2N2O
Molecular Weight316.35 g/mol
Exact Mass316.14
IUPAC NameN-[4-fluoro-2-(4-fluorophenyl)phenyl]piperidine-3-carboxamide
SMILESO=C(Nc1ccc(F)cc1-c1ccc(F)cc1)C1CCCNC1
InChIInChI=1S/C18H18F2N2O/c19-14-5-3-12(4-6-14)16-10-15(20)7-8-17(16)22-18(23)13-2-1-9-21-11-13/h3-8,10,13,21H,1-2,9,11H2,(H,22,23)
InChIKeyZZTFCLMCUHAMFX-UHFFFAOYSA-N
XLogP3.57
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.35
LogP ≤ 53.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(3R)-N-(2-chloro-4-fluorophenyl)piperidine-3-carboxamide
CID 29080451
N-[4-fluoro-2-(4-fluorophenyl)phenyl]piperidine-4-carboxamide;hydrochloride
CID 119316629
(3R)-N-(2-ethoxy-4-fluorophenyl)piperidine-3-carboxamide
CID 81124349
N-[2-(cyclopropylmethoxy)-4-fluorophenyl]piperidine-3-carboxamide;hydrochloride
CID 119333297
3-amino-N-[4-fluoro-2-(4-fluorophenyl)phenyl]cyclohexane-1-carboxamide;hydrochloride
CID 119771657
N-[4-fluoro-2-(2,2,2-trifluoroethoxy)phenyl]piperidine-3-carboxamide;hydrochloride
CID 119324692
(3S)-N-(2,3,5-trifluorophenyl)piperidine-3-carboxamide
CID 81139845
(3S)-N-(5-chloro-2-fluorophenyl)piperidine-3-carboxamide
CID 81124041
N-[4-fluoro-2-(4-fluorophenyl)phenyl]-3-piperidin-3-ylbutanamide
CID 119771660
N-(2-fluoro-4-methylphenyl)piperidine-3-carboxamide;hydrochloride
CID 119263786
N-[4-fluoro-2-(piperidine-3-carbonylamino)phenyl]pyridine-2-carboxamide
CID 119844811
N-(2-fluoro-5-methylphenyl)piperidine-3-carboxamide;hydrochloride
CID 119264146

Frequently Asked Questions

What is the IUPAC name of N-[4-fluoro-2-(4-fluorophenyl)phenyl]piperidine-3-carboxamide?
The IUPAC name of N-[4-fluoro-2-(4-fluorophenyl)phenyl]piperidine-3-carboxamide (CID 119316632) is N-[4-fluoro-2-(4-fluorophenyl)phenyl]piperidine-3-carboxamide.
What is the SMILES notation for N-[4-fluoro-2-(4-fluorophenyl)phenyl]piperidine-3-carboxamide?
The canonical SMILES for N-[4-fluoro-2-(4-fluorophenyl)phenyl]piperidine-3-carboxamide is O=C(Nc1ccc(F)cc1-c1ccc(F)cc1)C1CCCNC1.
What is the InChIKey of N-[4-fluoro-2-(4-fluorophenyl)phenyl]piperidine-3-carboxamide?
The InChIKey is ZZTFCLMCUHAMFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18F2N2O/c19-14-5-3-12(4-6-14)16-10-15(20)7-8-17(16)22-18(23)13-2-1-9-21-11-13/h3-8,10,13,21H,1-2,9,11H2,(H,22,23).
What are the key properties of N-[4-fluoro-2-(4-fluorophenyl)phenyl]piperidine-3-carboxamide?
N-[4-fluoro-2-(4-fluorophenyl)phenyl]piperidine-3-carboxamide has a molecular weight of 316.35 g/mol, XLogP of 3.57, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-fluoro-2-(4-fluorophenyl)phenyl]piperidine-3-carboxamide is sourced from PubChem (CID 119316632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).