N-[2-(2-fluorophenyl)ethyl]-1-(2-pyridin-2-ylethyl)piperidine-4-carboxamide

C21H26FN3O — CID 47056014

IUPACN-[2-(2-fluorophenyl)ethyl]-1-(2-pyridin-2-ylethyl)piperidine-4-carboxamide
SMILESO=C(NCCc1ccccc1F)C1CCN(CCc2ccccn2)CC1
InChIInChI=1S/C21H26FN3O/c22-20-7-2-1-5-17(20)8-13-24-21(26)18-9-14-25(15-10-18)16-11-19-6-3-4-12-23-19/h1-7,12,18H,8-11,13-16H2,(H,24,26)
InChIKeyYDXQDJJXXBFOGR-UHFFFAOYSA-N
MW355.46 g/mol
LogP2.83
Rot. Bonds7

About N-[2-(2-fluorophenyl)ethyl]-1-(2-pyridin-2-ylethyl)piperidine-4-carboxamide

N-[2-(2-fluorophenyl)ethyl]-1-(2-pyridin-2-ylethyl)piperidine-4-carboxamide (PubChem CID 47056014) has the molecular formula C21H26FN3O and a molecular weight of 355.46 g/mol. Its IUPAC name is N-[2-(2-fluorophenyl)ethyl]-1-(2-pyridin-2-ylethyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-[2-(2-fluorophenyl)ethyl]-1-(2-pyridin-2-ylethyl)piperidine-4-carboxamide
PubChem CID47056014
Molecular FormulaC21H26FN3O
Molecular Weight355.46 g/mol
Exact Mass355.21
IUPAC NameN-[2-(2-fluorophenyl)ethyl]-1-(2-pyridin-2-ylethyl)piperidine-4-carboxamide
SMILESO=C(NCCc1ccccc1F)C1CCN(CCc2ccccn2)CC1
InChIInChI=1S/C21H26FN3O/c22-20-7-2-1-5-17(20)8-13-24-21(26)18-9-14-25(15-10-18)16-11-19-6-3-4-12-23-19/h1-7,12,18H,8-11,13-16H2,(H,24,26)
InChIKeyYDXQDJJXXBFOGR-UHFFFAOYSA-N
XLogP2.83
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.46
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-acetyl-N-[2-(2-fluorophenyl)ethyl]piperidine-4-carboxamide
CID 9268566
1-(cyclopropanecarbonyl)-N-[2-(2-fluorophenyl)ethyl]piperidine-4-carboxamide
CID 39713860
1-N-cyclopropyl-4-N-[2-(2-fluorophenyl)ethyl]piperidine-1,4-dicarboxamide
CID 113004650
N-[2-(2-fluorophenyl)ethyl]cyclohexanecarboxamide
CID 78792132
N-(2-pyridin-2-ylethyl)cyclopentanecarboxamide
CID 110872250
methyl 1-(2-pyridin-2-ylethyl)piperidine-4-carboxylate
CID 60648150
1-(3-aminopyrazine-2-carbonyl)-N-[2-(2-fluorophenyl)ethyl]piperidine-4-carboxamide
CID 47057526
N-[2-(2-fluorophenyl)ethyl]-2-pyridin-2-ylacetamide
CID 110696924
N-[2-(2-fluorophenyl)ethyl]-4-(pyrrolidine-1-carbonyl)cyclohexane-1-carboxamide
CID 109145613
N-[2-(2-fluorophenyl)ethyl]-1-(2-morpholin-4-yl-2-oxoethyl)piperidine-4-carboxamide
CID 55738783
1-(2,2-dimethylpropanoyl)-N-[2-(2-fluorophenyl)ethyl]piperidine-4-carboxamide
CID 51181932
4-hydroxy-N-(2-pyridin-2-ylethyl)cyclohexane-1-carboxamide
CID 112530288

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-fluorophenyl)ethyl]-1-(2-pyridin-2-ylethyl)piperidine-4-carboxamide?
The IUPAC name of N-[2-(2-fluorophenyl)ethyl]-1-(2-pyridin-2-ylethyl)piperidine-4-carboxamide (CID 47056014) is N-[2-(2-fluorophenyl)ethyl]-1-(2-pyridin-2-ylethyl)piperidine-4-carboxamide.
What is the SMILES notation for N-[2-(2-fluorophenyl)ethyl]-1-(2-pyridin-2-ylethyl)piperidine-4-carboxamide?
The canonical SMILES for N-[2-(2-fluorophenyl)ethyl]-1-(2-pyridin-2-ylethyl)piperidine-4-carboxamide is O=C(NCCc1ccccc1F)C1CCN(CCc2ccccn2)CC1.
What is the InChIKey of N-[2-(2-fluorophenyl)ethyl]-1-(2-pyridin-2-ylethyl)piperidine-4-carboxamide?
The InChIKey is YDXQDJJXXBFOGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26FN3O/c22-20-7-2-1-5-17(20)8-13-24-21(26)18-9-14-25(15-10-18)16-11-19-6-3-4-12-23-19/h1-7,12,18H,8-11,13-16H2,(H,24,26).
What are the key properties of N-[2-(2-fluorophenyl)ethyl]-1-(2-pyridin-2-ylethyl)piperidine-4-carboxamide?
N-[2-(2-fluorophenyl)ethyl]-1-(2-pyridin-2-ylethyl)piperidine-4-carboxamide has a molecular weight of 355.46 g/mol, XLogP of 2.83, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-fluorophenyl)ethyl]-1-(2-pyridin-2-ylethyl)piperidine-4-carboxamide is sourced from PubChem (CID 47056014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).