1-(4-fluorobenzoyl)-N-(1-phenylcyclobutyl)piperidine-3-carboxamide

C23H25FN2O2 — CID 51273264

IUPAC1-(4-fluorobenzoyl)-N-(1-phenylcyclobutyl)piperidine-3-carboxamide
SMILESO=C(NC1(c2ccccc2)CCC1)C1CCCN(C(=O)c2ccc(F)cc2)C1
InChIInChI=1S/C23H25FN2O2/c24-20-11-9-17(10-12-20)22(28)26-15-4-6-18(16-26)21(27)25-23(13-5-14-23)19-7-2-1-3-8-19/h1-3,7-12,18H,4-6,13-16H2,(H,25,27)
InChIKeyICZVVHKUZFEMRW-UHFFFAOYSA-N
MW380.46 g/mol
LogP3.87
Rot. Bonds4

About 1-(4-fluorobenzoyl)-N-(1-phenylcyclobutyl)piperidine-3-carboxamide

1-(4-fluorobenzoyl)-N-(1-phenylcyclobutyl)piperidine-3-carboxamide (PubChem CID 51273264) has the molecular formula C23H25FN2O2 and a molecular weight of 380.46 g/mol. Its IUPAC name is 1-(4-fluorobenzoyl)-N-(1-phenylcyclobutyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name1-(4-fluorobenzoyl)-N-(1-phenylcyclobutyl)piperidine-3-carboxamide
PubChem CID51273264
Molecular FormulaC23H25FN2O2
Molecular Weight380.46 g/mol
Exact Mass380.19
IUPAC Name1-(4-fluorobenzoyl)-N-(1-phenylcyclobutyl)piperidine-3-carboxamide
SMILESO=C(NC1(c2ccccc2)CCC1)C1CCCN(C(=O)c2ccc(F)cc2)C1
InChIInChI=1S/C23H25FN2O2/c24-20-11-9-17(10-12-20)22(28)26-15-4-6-18(16-26)21(27)25-23(13-5-14-23)19-7-2-1-3-8-19/h1-3,7-12,18H,4-6,13-16H2,(H,25,27)
InChIKeyICZVVHKUZFEMRW-UHFFFAOYSA-N
XLogP3.87
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.46
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-fluorobenzoyl)piperidine-3-carbohydrazide
CID 54793956
1-(4-fluorobenzoyl)-N-methylpiperidine-3-carboxamide
CID 47128312
N-[[1-(4-fluorobenzoyl)piperidine-3-carbonyl]amino]formamide
CID 174516227
(3S)-1-(4-fluorobenzoyl)-N-[(2R)-4-phenylbutan-2-yl]piperidine-3-carboxamide
CID 39724050
(3R)-N-cyclopentyl-1-(4-fluorobenzoyl)piperidine-3-carboxamide
CID 25392682
N-(2-chlorophenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide
CID 51272015
(3S)-1-acetyl-N-(1-phenylcyclopentyl)pyrrolidine-3-carboxamide
CID 92633244
[(3R)-1-(4-fluorobenzoyl)piperidin-3-yl]-piperidin-1-ylmethanone
CID 936701
1-(4-fluorobenzoyl)-N-(5-phenyl-2-pyridinyl)piperidine-3-carboxamide
CID 55952573
1-(4-fluorobenzoyl)-N-(2-phenylsulfanylethyl)piperidine-3-carboxamide
CID 51272724
(3S)-1-(4-fluorobenzoyl)piperidine-3-carboxamide
CID 68704612
1-(4-fluorobenzoyl)-N-[(1-phenylpyrrolidin-3-yl)methyl]piperidine-3-carboxamide
CID 46403336

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorobenzoyl)-N-(1-phenylcyclobutyl)piperidine-3-carboxamide?
The IUPAC name of 1-(4-fluorobenzoyl)-N-(1-phenylcyclobutyl)piperidine-3-carboxamide (CID 51273264) is 1-(4-fluorobenzoyl)-N-(1-phenylcyclobutyl)piperidine-3-carboxamide.
What is the SMILES notation for 1-(4-fluorobenzoyl)-N-(1-phenylcyclobutyl)piperidine-3-carboxamide?
The canonical SMILES for 1-(4-fluorobenzoyl)-N-(1-phenylcyclobutyl)piperidine-3-carboxamide is O=C(NC1(c2ccccc2)CCC1)C1CCCN(C(=O)c2ccc(F)cc2)C1.
What is the InChIKey of 1-(4-fluorobenzoyl)-N-(1-phenylcyclobutyl)piperidine-3-carboxamide?
The InChIKey is ICZVVHKUZFEMRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25FN2O2/c24-20-11-9-17(10-12-20)22(28)26-15-4-6-18(16-26)21(27)25-23(13-5-14-23)19-7-2-1-3-8-19/h1-3,7-12,18H,4-6,13-16H2,(H,25,27).
What are the key properties of 1-(4-fluorobenzoyl)-N-(1-phenylcyclobutyl)piperidine-3-carboxamide?
1-(4-fluorobenzoyl)-N-(1-phenylcyclobutyl)piperidine-3-carboxamide has a molecular weight of 380.46 g/mol, XLogP of 3.87, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorobenzoyl)-N-(1-phenylcyclobutyl)piperidine-3-carboxamide is sourced from PubChem (CID 51273264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).