N-(3-fluorophenyl)-4-phenylpiperidine-1-carboxamide

C18H19FN2O — CID 3595370

IUPACN-(3-fluorophenyl)-4-phenylpiperidine-1-carboxamide
SMILESO=C(Nc1cccc(F)c1)N1CCC(c2ccccc2)CC1
InChIInChI=1S/C18H19FN2O/c19-16-7-4-8-17(13-16)20-18(22)21-11-9-15(10-12-21)14-5-2-1-3-6-14/h1-8,13,15H,9-12H2,(H,20,22)
InChIKeyHGWRIRJTKBAGMI-UHFFFAOYSA-N
MW298.36 g/mol
LogP4.24
Rot. Bonds2

About N-(3-fluorophenyl)-4-phenylpiperidine-1-carboxamide

N-(3-fluorophenyl)-4-phenylpiperidine-1-carboxamide (PubChem CID 3595370) has the molecular formula C18H19FN2O and a molecular weight of 298.36 g/mol. Its IUPAC name is N-(3-fluorophenyl)-4-phenylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN-(3-fluorophenyl)-4-phenylpiperidine-1-carboxamide
PubChem CID3595370
Molecular FormulaC18H19FN2O
Molecular Weight298.36 g/mol
Exact Mass298.15
IUPAC NameN-(3-fluorophenyl)-4-phenylpiperidine-1-carboxamide
SMILESO=C(Nc1cccc(F)c1)N1CCC(c2ccccc2)CC1
InChIInChI=1S/C18H19FN2O/c19-16-7-4-8-17(13-16)20-18(22)21-11-9-15(10-12-21)14-5-2-1-3-6-14/h1-8,13,15H,9-12H2,(H,20,22)
InChIKeyHGWRIRJTKBAGMI-UHFFFAOYSA-N
XLogP4.24
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.36
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-4-phenylpiperidine-1-carboxamide?
The IUPAC name of N-(3-fluorophenyl)-4-phenylpiperidine-1-carboxamide (CID 3595370) is N-(3-fluorophenyl)-4-phenylpiperidine-1-carboxamide.
What is the SMILES notation for N-(3-fluorophenyl)-4-phenylpiperidine-1-carboxamide?
The canonical SMILES for N-(3-fluorophenyl)-4-phenylpiperidine-1-carboxamide is O=C(Nc1cccc(F)c1)N1CCC(c2ccccc2)CC1.
What is the InChIKey of N-(3-fluorophenyl)-4-phenylpiperidine-1-carboxamide?
The InChIKey is HGWRIRJTKBAGMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN2O/c19-16-7-4-8-17(13-16)20-18(22)21-11-9-15(10-12-21)14-5-2-1-3-6-14/h1-8,13,15H,9-12H2,(H,20,22).
What are the key properties of N-(3-fluorophenyl)-4-phenylpiperidine-1-carboxamide?
N-(3-fluorophenyl)-4-phenylpiperidine-1-carboxamide has a molecular weight of 298.36 g/mol, XLogP of 4.24, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-4-phenylpiperidine-1-carboxamide is sourced from PubChem (CID 3595370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).