1-(2-fluorophenyl)-N-(4-fluorophenyl)piperidine-4-carboxamide

C18H18F2N2O — CID 17152616

IUPAC1-(2-fluorophenyl)-N-(4-fluorophenyl)piperidine-4-carboxamide
SMILESO=C(Nc1ccc(F)cc1)C1CCN(c2ccccc2F)CC1
InChIInChI=1S/C18H18F2N2O/c19-14-5-7-15(8-6-14)21-18(23)13-9-11-22(12-10-13)17-4-2-1-3-16(17)20/h1-8,13H,9-12H2,(H,21,23)
InChIKeyOMJPRDMJBQWJAI-UHFFFAOYSA-N
MW316.35 g/mol
LogP3.82
Rot. Bonds3

About 1-(2-fluorophenyl)-N-(4-fluorophenyl)piperidine-4-carboxamide

1-(2-fluorophenyl)-N-(4-fluorophenyl)piperidine-4-carboxamide (PubChem CID 17152616) has the molecular formula C18H18F2N2O and a molecular weight of 316.35 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-N-(4-fluorophenyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(2-fluorophenyl)-N-(4-fluorophenyl)piperidine-4-carboxamide
PubChem CID17152616
Molecular FormulaC18H18F2N2O
Molecular Weight316.35 g/mol
Exact Mass316.14
IUPAC Name1-(2-fluorophenyl)-N-(4-fluorophenyl)piperidine-4-carboxamide
SMILESO=C(Nc1ccc(F)cc1)C1CCN(c2ccccc2F)CC1
InChIInChI=1S/C18H18F2N2O/c19-14-5-7-15(8-6-14)21-18(23)13-9-11-22(12-10-13)17-4-2-1-3-16(17)20/h1-8,13H,9-12H2,(H,21,23)
InChIKeyOMJPRDMJBQWJAI-UHFFFAOYSA-N
XLogP3.82
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.35
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-N-(4-fluorophenyl)piperidine-4-carboxamide?
The IUPAC name of 1-(2-fluorophenyl)-N-(4-fluorophenyl)piperidine-4-carboxamide (CID 17152616) is 1-(2-fluorophenyl)-N-(4-fluorophenyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(2-fluorophenyl)-N-(4-fluorophenyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(2-fluorophenyl)-N-(4-fluorophenyl)piperidine-4-carboxamide is O=C(Nc1ccc(F)cc1)C1CCN(c2ccccc2F)CC1.
What is the InChIKey of 1-(2-fluorophenyl)-N-(4-fluorophenyl)piperidine-4-carboxamide?
The InChIKey is OMJPRDMJBQWJAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18F2N2O/c19-14-5-7-15(8-6-14)21-18(23)13-9-11-22(12-10-13)17-4-2-1-3-16(17)20/h1-8,13H,9-12H2,(H,21,23).
What are the key properties of 1-(2-fluorophenyl)-N-(4-fluorophenyl)piperidine-4-carboxamide?
1-(2-fluorophenyl)-N-(4-fluorophenyl)piperidine-4-carboxamide has a molecular weight of 316.35 g/mol, XLogP of 3.82, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-N-(4-fluorophenyl)piperidine-4-carboxamide is sourced from PubChem (CID 17152616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).