2-ethyl-N-[2-(2-fluorophenoxy)ethyl]piperidine-1-carboxamide

C16H23FN2O2 — CID 112970222

IUPAC2-ethyl-N-[2-(2-fluorophenoxy)ethyl]piperidine-1-carboxamide
SMILESCCC1CCCCN1C(=O)NCCOc1ccccc1F
InChIInChI=1S/C16H23FN2O2/c1-2-13-7-5-6-11-19(13)16(20)18-10-12-21-15-9-4-3-8-14(15)17/h3-4,8-9,13H,2,5-7,10-12H2,1H3,(H,18,20)
InChIKeyMAEFFYSKQXUYMF-UHFFFAOYSA-N
MW294.37 g/mol
LogP3.18
Rot. Bonds5

About 2-ethyl-N-[2-(2-fluorophenoxy)ethyl]piperidine-1-carboxamide

2-ethyl-N-[2-(2-fluorophenoxy)ethyl]piperidine-1-carboxamide (PubChem CID 112970222) has the molecular formula C16H23FN2O2 and a molecular weight of 294.37 g/mol. Its IUPAC name is 2-ethyl-N-[2-(2-fluorophenoxy)ethyl]piperidine-1-carboxamide.

Molecular Properties

Compound Name2-ethyl-N-[2-(2-fluorophenoxy)ethyl]piperidine-1-carboxamide
PubChem CID112970222
Molecular FormulaC16H23FN2O2
Molecular Weight294.37 g/mol
Exact Mass294.17
IUPAC Name2-ethyl-N-[2-(2-fluorophenoxy)ethyl]piperidine-1-carboxamide
SMILESCCC1CCCCN1C(=O)NCCOc1ccccc1F
InChIInChI=1S/C16H23FN2O2/c1-2-13-7-5-6-11-19(13)16(20)18-10-12-21-15-9-4-3-8-14(15)17/h3-4,8-9,13H,2,5-7,10-12H2,1H3,(H,18,20)
InChIKeyMAEFFYSKQXUYMF-UHFFFAOYSA-N
XLogP3.18
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.37
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

(2R)-N-[2-(2-fluorophenoxy)ethyl]-2-(furan-2-yl)azepane-1-carboxamide
CID 126445655
N-[2-(3,5-dimethoxyphenoxy)ethyl]-2-ethylpiperidine-1-carboxamide
CID 112975668
N-(2,6-difluorophenyl)-2-ethylpiperidine-1-carboxamide
CID 108990928
N-[2-(4-chloro-3,5-dimethylphenoxy)ethyl]-2-ethylpiperidine-1-carboxamide
CID 112977193
N-(2-ethoxyphenyl)-2-ethylpiperidine-1-carboxamide
CID 6468578
3-amino-N-[[1-[3-(2-fluorophenoxy)propanoyl]piperidin-2-yl]methyl]propanamide
CID 120580345
1-[2-(aminomethyl)piperidin-1-yl]-3-(2-fluorophenoxy)propan-1-one;hydrochloride
CID 119467095
N-[3-(1,3-dioxoisoindol-2-yl)propyl]-2-ethylpiperidine-1-carboxamide
CID 108889482
(2S)-2-(ethoxymethyl)-N-[2-(4-fluorophenoxy)ethyl]pyrrolidine-1-carboxamide
CID 126429890
(2R)-2-ethyl-N-phenylpiperidine-1-carboxamide
CID 728630
2-(2-hydroxyethyl)-N-[(2-propoxyphenyl)methyl]piperidine-1-carboxamide
CID 122568396
(2S)-2-(2-hydroxyethyl)-N-[(2-propoxyphenyl)methyl]piperidine-1-carboxamide
CID 125444999

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-[2-(2-fluorophenoxy)ethyl]piperidine-1-carboxamide?
The IUPAC name of 2-ethyl-N-[2-(2-fluorophenoxy)ethyl]piperidine-1-carboxamide (CID 112970222) is 2-ethyl-N-[2-(2-fluorophenoxy)ethyl]piperidine-1-carboxamide.
What is the SMILES notation for 2-ethyl-N-[2-(2-fluorophenoxy)ethyl]piperidine-1-carboxamide?
The canonical SMILES for 2-ethyl-N-[2-(2-fluorophenoxy)ethyl]piperidine-1-carboxamide is CCC1CCCCN1C(=O)NCCOc1ccccc1F.
What is the InChIKey of 2-ethyl-N-[2-(2-fluorophenoxy)ethyl]piperidine-1-carboxamide?
The InChIKey is MAEFFYSKQXUYMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23FN2O2/c1-2-13-7-5-6-11-19(13)16(20)18-10-12-21-15-9-4-3-8-14(15)17/h3-4,8-9,13H,2,5-7,10-12H2,1H3,(H,18,20).
What are the key properties of 2-ethyl-N-[2-(2-fluorophenoxy)ethyl]piperidine-1-carboxamide?
2-ethyl-N-[2-(2-fluorophenoxy)ethyl]piperidine-1-carboxamide has a molecular weight of 294.37 g/mol, XLogP of 3.18, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-[2-(2-fluorophenoxy)ethyl]piperidine-1-carboxamide is sourced from PubChem (CID 112970222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).