1-(4-fluorobenzoyl)-N-quinolin-8-ylpiperidine-4-carboxamide

C22H20FN3O2 — CID 26123213

IUPAC1-(4-fluorobenzoyl)-N-quinolin-8-ylpiperidine-4-carboxamide
SMILESO=C(Nc1cccc2cccnc12)C1CCN(C(=O)c2ccc(F)cc2)CC1
InChIInChI=1S/C22H20FN3O2/c23-18-8-6-17(7-9-18)22(28)26-13-10-16(11-14-26)21(27)25-19-5-1-3-15-4-2-12-24-20(15)19/h1-9,12,16H,10-11,13-14H2,(H,25,27)
InChIKeyWUUZFZWPSUGZJU-UHFFFAOYSA-N
MW377.42 g/mol
LogP3.86
Rot. Bonds3

About 1-(4-fluorobenzoyl)-N-quinolin-8-ylpiperidine-4-carboxamide

1-(4-fluorobenzoyl)-N-quinolin-8-ylpiperidine-4-carboxamide (PubChem CID 26123213) has the molecular formula C22H20FN3O2 and a molecular weight of 377.42 g/mol. Its IUPAC name is 1-(4-fluorobenzoyl)-N-quinolin-8-ylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-(4-fluorobenzoyl)-N-quinolin-8-ylpiperidine-4-carboxamide
PubChem CID26123213
Molecular FormulaC22H20FN3O2
Molecular Weight377.42 g/mol
Exact Mass377.15
IUPAC Name1-(4-fluorobenzoyl)-N-quinolin-8-ylpiperidine-4-carboxamide
SMILESO=C(Nc1cccc2cccnc12)C1CCN(C(=O)c2ccc(F)cc2)CC1
InChIInChI=1S/C22H20FN3O2/c23-18-8-6-17(7-9-18)22(28)26-13-10-16(11-14-26)21(27)25-19-5-1-3-15-4-2-12-24-20(15)19/h1-9,12,16H,10-11,13-14H2,(H,25,27)
InChIKeyWUUZFZWPSUGZJU-UHFFFAOYSA-N
XLogP3.86
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.42
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(cyclobutanecarbonyl)-N-quinolin-8-ylpiperidine-4-carboxamide
CID 113008383
N-(2,3-dichlorophenyl)-1-(4-fluorobenzoyl)piperidine-4-carboxamide
CID 1327552
1-[2-(2-fluorophenyl)acetyl]-N-quinolin-8-ylpiperidine-4-carboxamide
CID 113008377
N-(6-chloroquinolin-8-yl)-1-(pyridine-4-carbonyl)piperidine-4-carboxamide
CID 37419359
1-(3-methylbutanoyl)-N-quinolin-8-ylpiperidine-4-carboxamide
CID 113008357
N-quinolin-8-ylcyclohexanecarboxamide
CID 835933
1-(4-fluorobenzoyl)-N-[2-(methylcarbamoyl)phenyl]piperidine-4-carboxamide
CID 51218219
1-(2-phenoxyacetyl)-N-quinolin-8-ylpiperidine-4-carboxamide
CID 113008372
N-[3-(cyclopropanecarbonylamino)phenyl]-1-(4-fluorobenzoyl)piperidine-4-carboxamide
CID 38324789
1-(4-fluorobenzoyl)-N-(2-propan-2-ylphenyl)piperidine-4-carboxamide
CID 17223875
N-[3-chloro-2-(dimethylamino)phenyl]-1-(4-fluorobenzoyl)piperidine-4-carboxamide
CID 55700862
1-benzoyl-N-(2-methyl-3-pyridinyl)piperidine-4-carboxamide
CID 154737923

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorobenzoyl)-N-quinolin-8-ylpiperidine-4-carboxamide?
The IUPAC name of 1-(4-fluorobenzoyl)-N-quinolin-8-ylpiperidine-4-carboxamide (CID 26123213) is 1-(4-fluorobenzoyl)-N-quinolin-8-ylpiperidine-4-carboxamide.
What is the SMILES notation for 1-(4-fluorobenzoyl)-N-quinolin-8-ylpiperidine-4-carboxamide?
The canonical SMILES for 1-(4-fluorobenzoyl)-N-quinolin-8-ylpiperidine-4-carboxamide is O=C(Nc1cccc2cccnc12)C1CCN(C(=O)c2ccc(F)cc2)CC1.
What is the InChIKey of 1-(4-fluorobenzoyl)-N-quinolin-8-ylpiperidine-4-carboxamide?
The InChIKey is WUUZFZWPSUGZJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20FN3O2/c23-18-8-6-17(7-9-18)22(28)26-13-10-16(11-14-26)21(27)25-19-5-1-3-15-4-2-12-24-20(15)19/h1-9,12,16H,10-11,13-14H2,(H,25,27).
What are the key properties of 1-(4-fluorobenzoyl)-N-quinolin-8-ylpiperidine-4-carboxamide?
1-(4-fluorobenzoyl)-N-quinolin-8-ylpiperidine-4-carboxamide has a molecular weight of 377.42 g/mol, XLogP of 3.86, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorobenzoyl)-N-quinolin-8-ylpiperidine-4-carboxamide is sourced from PubChem (CID 26123213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).