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

C20H21FN2O3 — CID 55631357

IUPACN-(4-fluorophenyl)-1-(2-phenoxyacetyl)piperidine-4-carboxamide
SMILESO=C(Nc1ccc(F)cc1)C1CCN(C(=O)COc2ccccc2)CC1
InChIInChI=1S/C20H21FN2O3/c21-16-6-8-17(9-7-16)22-20(25)15-10-12-23(13-11-15)19(24)14-26-18-4-2-1-3-5-18/h1-9,15H,10-14H2,(H,22,25)
InChIKeyVGBYIQYIGVYKKA-UHFFFAOYSA-N
MW356.40 g/mol
LogP3.08
Rot. Bonds5

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

N-(4-fluorophenyl)-1-(2-phenoxyacetyl)piperidine-4-carboxamide (PubChem CID 55631357) has the molecular formula C20H21FN2O3 and a molecular weight of 356.40 g/mol. Its IUPAC name is N-(4-fluorophenyl)-1-(2-phenoxyacetyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-1-(2-phenoxyacetyl)piperidine-4-carboxamide
PubChem CID55631357
Molecular FormulaC20H21FN2O3
Molecular Weight356.40 g/mol
Exact Mass356.15
IUPAC NameN-(4-fluorophenyl)-1-(2-phenoxyacetyl)piperidine-4-carboxamide
SMILESO=C(Nc1ccc(F)cc1)C1CCN(C(=O)COc2ccccc2)CC1
InChIInChI=1S/C20H21FN2O3/c21-16-6-8-17(9-7-16)22-20(25)15-10-12-23(13-11-15)19(24)14-26-18-4-2-1-3-5-18/h1-9,15H,10-14H2,(H,22,25)
InChIKeyVGBYIQYIGVYKKA-UHFFFAOYSA-N
XLogP3.08
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.40
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-acetamidophenyl)-1-(2-phenoxyacetyl)piperidine-4-carboxamide
CID 55631454
N-[4-(2-methoxyphenoxy)phenyl]-1-(2-phenoxyacetyl)piperidine-4-carboxamide
CID 46409832
N-phenyl-1-[2-(4-propoxyphenoxy)acetyl]piperidine-4-carboxamide
CID 41499383
N-benzyl-1-[2-(4-fluorophenoxy)acetyl]piperidine-4-carboxamide
CID 26456587
N-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-1-(2-phenoxyacetyl)piperidine-4-carboxamide
CID 55633115
1-[2-(3-iodophenoxy)acetyl]-N-phenylpiperidine-4-carboxamide
CID 36562759
N-phenyl-1-[2-(4-propanoylphenoxy)acetyl]piperidine-4-carboxamide
CID 51214187
N-(1-methylpyrazol-4-yl)-1-(2-phenoxyacetyl)piperidine-4-carboxamide
CID 32609867
N-[3-[2-(ethylamino)-2-oxoethoxy]phenyl]-1-(2-phenoxyacetyl)piperidine-4-carboxamide
CID 34874597
N-(6-imidazol-1-yl-3-pyridinyl)-1-(2-phenoxyacetyl)piperidine-4-carboxamide
CID 55632262
N-(4-acetamidophenyl)-1-(3-phenoxypropanoyl)piperidine-4-carboxamide
CID 55854580
N-[6-[4-(2-phenoxyacetyl)piperazin-1-yl]-3-pyridinyl]cyclopentanecarboxamide
CID 42850034

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-1-(2-phenoxyacetyl)piperidine-4-carboxamide?
The IUPAC name of N-(4-fluorophenyl)-1-(2-phenoxyacetyl)piperidine-4-carboxamide (CID 55631357) is N-(4-fluorophenyl)-1-(2-phenoxyacetyl)piperidine-4-carboxamide.
What is the SMILES notation for N-(4-fluorophenyl)-1-(2-phenoxyacetyl)piperidine-4-carboxamide?
The canonical SMILES for N-(4-fluorophenyl)-1-(2-phenoxyacetyl)piperidine-4-carboxamide is O=C(Nc1ccc(F)cc1)C1CCN(C(=O)COc2ccccc2)CC1.
What is the InChIKey of N-(4-fluorophenyl)-1-(2-phenoxyacetyl)piperidine-4-carboxamide?
The InChIKey is VGBYIQYIGVYKKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21FN2O3/c21-16-6-8-17(9-7-16)22-20(25)15-10-12-23(13-11-15)19(24)14-26-18-4-2-1-3-5-18/h1-9,15H,10-14H2,(H,22,25).
What are the key properties of N-(4-fluorophenyl)-1-(2-phenoxyacetyl)piperidine-4-carboxamide?
N-(4-fluorophenyl)-1-(2-phenoxyacetyl)piperidine-4-carboxamide has a molecular weight of 356.40 g/mol, XLogP of 3.08, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-1-(2-phenoxyacetyl)piperidine-4-carboxamide is sourced from PubChem (CID 55631357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).