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

C16H21FN2O2 — CID 9268566

IUPAC1-acetyl-N-[2-(2-fluorophenyl)ethyl]piperidine-4-carboxamide
SMILESCC(=O)N1CCC(C(=O)NCCc2ccccc2F)CC1
InChIInChI=1S/C16H21FN2O2/c1-12(20)19-10-7-14(8-11-19)16(21)18-9-6-13-4-2-3-5-15(13)17/h2-5,14H,6-11H2,1H3,(H,18,21)
InChIKeyLRDYXLAPUJUEMB-UHFFFAOYSA-N
MW292.35 g/mol
LogP1.74
Rot. Bonds4

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

1-acetyl-N-[2-(2-fluorophenyl)ethyl]piperidine-4-carboxamide (PubChem CID 9268566) has the molecular formula C16H21FN2O2 and a molecular weight of 292.35 g/mol. Its IUPAC name is 1-acetyl-N-[2-(2-fluorophenyl)ethyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-acetyl-N-[2-(2-fluorophenyl)ethyl]piperidine-4-carboxamide
PubChem CID9268566
Molecular FormulaC16H21FN2O2
Molecular Weight292.35 g/mol
Exact Mass292.16
IUPAC Name1-acetyl-N-[2-(2-fluorophenyl)ethyl]piperidine-4-carboxamide
SMILESCC(=O)N1CCC(C(=O)NCCc2ccccc2F)CC1
InChIInChI=1S/C16H21FN2O2/c1-12(20)19-10-7-14(8-11-19)16(21)18-9-6-13-4-2-3-5-15(13)17/h2-5,14H,6-11H2,1H3,(H,18,21)
InChIKeyLRDYXLAPUJUEMB-UHFFFAOYSA-N
XLogP1.74
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.35
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(cyclopropanecarbonyl)-N-[2-(2-fluorophenyl)ethyl]piperidine-4-carboxamide
CID 39713860
1-(2,2-dimethylpropanoyl)-N-[2-(2-fluorophenyl)ethyl]piperidine-4-carboxamide
CID 51181932
ethyl 4-[2-(2-fluorophenyl)ethylcarbamoyl]piperidine-1-carboxylate
CID 39709187
1-N-cyclopropyl-4-N-[2-(2-fluorophenyl)ethyl]piperidine-1,4-dicarboxamide
CID 113004650
1-acetyl-N-[2-(2-hydroxyphenyl)ethyl]piperidine-4-carboxamide
CID 110672379
N-[2-(2-fluorophenyl)ethyl]-1-(3-methylsulfanylpropanoyl)piperidine-4-carboxamide
CID 55778984
N-[2-(2-fluorophenyl)ethyl]-4-(pyrrolidine-1-carbonyl)cyclohexane-1-carboxamide
CID 109145613
N-[2-(2-fluorophenyl)ethyl]-1-[2-(trifluoromethylsulfanyl)acetyl]piperidine-4-carboxamide
CID 55779186
N-[2-(2-fluorophenyl)ethyl]cyclohexanecarboxamide
CID 78792132
1-[3-(4-ethylphenyl)propanoyl]-N-[2-(2-fluorophenyl)ethyl]piperidine-4-carboxamide
CID 55778891
N-[2-(2-fluorophenyl)ethyl]-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 27848033
1-(5-chloro-2-fluorobenzoyl)-N-[2-(2-fluorophenyl)ethyl]piperidine-4-carboxamide
CID 55779052

Frequently Asked Questions

What is the IUPAC name of 1-acetyl-N-[2-(2-fluorophenyl)ethyl]piperidine-4-carboxamide?
The IUPAC name of 1-acetyl-N-[2-(2-fluorophenyl)ethyl]piperidine-4-carboxamide (CID 9268566) is 1-acetyl-N-[2-(2-fluorophenyl)ethyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-acetyl-N-[2-(2-fluorophenyl)ethyl]piperidine-4-carboxamide?
The canonical SMILES for 1-acetyl-N-[2-(2-fluorophenyl)ethyl]piperidine-4-carboxamide is CC(=O)N1CCC(C(=O)NCCc2ccccc2F)CC1.
What is the InChIKey of 1-acetyl-N-[2-(2-fluorophenyl)ethyl]piperidine-4-carboxamide?
The InChIKey is LRDYXLAPUJUEMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21FN2O2/c1-12(20)19-10-7-14(8-11-19)16(21)18-9-6-13-4-2-3-5-15(13)17/h2-5,14H,6-11H2,1H3,(H,18,21).
What are the key properties of 1-acetyl-N-[2-(2-fluorophenyl)ethyl]piperidine-4-carboxamide?
1-acetyl-N-[2-(2-fluorophenyl)ethyl]piperidine-4-carboxamide has a molecular weight of 292.35 g/mol, XLogP of 1.74, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-acetyl-N-[2-(2-fluorophenyl)ethyl]piperidine-4-carboxamide is sourced from PubChem (CID 9268566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).