N-[2-(2-fluorophenoxy)ethyl]-N-methyl-6-oxopiperidine-3-carboxamide

C15H19FN2O3 — CID 73420162

IUPACN-[2-(2-fluorophenoxy)ethyl]-N-methyl-6-oxopiperidine-3-carboxamide
SMILESCN(CCOc1ccccc1F)C(=O)C1CCC(=O)NC1
InChIInChI=1S/C15H19FN2O3/c1-18(15(20)11-6-7-14(19)17-10-11)8-9-21-13-5-3-2-4-12(13)16/h2-5,11H,6-10H2,1H3,(H,17,19)
InChIKeySSBRGSLWWZKXKK-UHFFFAOYSA-N
MW294.33 g/mol
LogP1.19
Rot. Bonds5

About N-[2-(2-fluorophenoxy)ethyl]-N-methyl-6-oxopiperidine-3-carboxamide

N-[2-(2-fluorophenoxy)ethyl]-N-methyl-6-oxopiperidine-3-carboxamide (PubChem CID 73420162) has the molecular formula C15H19FN2O3 and a molecular weight of 294.33 g/mol. Its IUPAC name is N-[2-(2-fluorophenoxy)ethyl]-N-methyl-6-oxopiperidine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(2-fluorophenoxy)ethyl]-N-methyl-6-oxopiperidine-3-carboxamide
PubChem CID73420162
Molecular FormulaC15H19FN2O3
Molecular Weight294.33 g/mol
Exact Mass294.14
IUPAC NameN-[2-(2-fluorophenoxy)ethyl]-N-methyl-6-oxopiperidine-3-carboxamide
SMILESCN(CCOc1ccccc1F)C(=O)C1CCC(=O)NC1
InChIInChI=1S/C15H19FN2O3/c1-18(15(20)11-6-7-14(19)17-10-11)8-9-21-13-5-3-2-4-12(13)16/h2-5,11H,6-10H2,1H3,(H,17,19)
InChIKeySSBRGSLWWZKXKK-UHFFFAOYSA-N
XLogP1.19
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.33
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(2-fluorophenoxy)ethyl]-N-methyl-5-oxopyrrolidine-3-carboxamide
CID 78982144
(3R)-N-[2-(2-fluorophenoxy)ethyl]-N-methylpiperidine-3-carboxamide
CID 81129858
N-[2-(2-fluorophenoxy)ethyl]-N-methyl-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide
CID 134036597
N-[(4-fluorophenyl)methyl]-N-methyl-6-oxopiperidine-3-carboxamide
CID 112728353
N-(2-fluorophenyl)-N-methyl-6-oxopiperidine-3-carboxamide
CID 78917930
N-methyl-6-oxo-N-(3-phenylpropyl)piperidine-3-carboxamide
CID 74878818
N-benzyl-N-methyl-6-oxopiperidine-3-carboxamide
CID 74464257
N-[2-(2-fluorophenoxy)ethyl]-N,3-dimethylpiperidine-2-carboxamide
CID 107067637
3-amino-N-[2-(2-fluorophenoxy)ethyl]-N-methylbicyclo[2.2.1]heptane-2-carboxamide
CID 119695560
4-amino-N-[2-(2-fluorophenoxy)ethyl]-N-methyloxolane-3-carboxamide
CID 66240651
N-[2-(2-methoxyphenoxy)ethyl]-N-methylpiperidine-3-carboxamide
CID 119294067
N-(3-hydroxybutyl)-N-methyl-6-oxopiperidine-3-carboxamide
CID 115691430

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-fluorophenoxy)ethyl]-N-methyl-6-oxopiperidine-3-carboxamide?
The IUPAC name of N-[2-(2-fluorophenoxy)ethyl]-N-methyl-6-oxopiperidine-3-carboxamide (CID 73420162) is N-[2-(2-fluorophenoxy)ethyl]-N-methyl-6-oxopiperidine-3-carboxamide.
What is the SMILES notation for N-[2-(2-fluorophenoxy)ethyl]-N-methyl-6-oxopiperidine-3-carboxamide?
The canonical SMILES for N-[2-(2-fluorophenoxy)ethyl]-N-methyl-6-oxopiperidine-3-carboxamide is CN(CCOc1ccccc1F)C(=O)C1CCC(=O)NC1.
What is the InChIKey of N-[2-(2-fluorophenoxy)ethyl]-N-methyl-6-oxopiperidine-3-carboxamide?
The InChIKey is SSBRGSLWWZKXKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN2O3/c1-18(15(20)11-6-7-14(19)17-10-11)8-9-21-13-5-3-2-4-12(13)16/h2-5,11H,6-10H2,1H3,(H,17,19).
What are the key properties of N-[2-(2-fluorophenoxy)ethyl]-N-methyl-6-oxopiperidine-3-carboxamide?
N-[2-(2-fluorophenoxy)ethyl]-N-methyl-6-oxopiperidine-3-carboxamide has a molecular weight of 294.33 g/mol, XLogP of 1.19, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-fluorophenoxy)ethyl]-N-methyl-6-oxopiperidine-3-carboxamide is sourced from PubChem (CID 73420162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).