N-(2-chlorophenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide

C19H18ClFN2O2 — CID 51272015

IUPACN-(2-chlorophenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide
SMILESO=C(Nc1ccccc1Cl)C1CCCN(C(=O)c2ccc(F)cc2)C1
InChIInChI=1S/C19H18ClFN2O2/c20-16-5-1-2-6-17(16)22-18(24)14-4-3-11-23(12-14)19(25)13-7-9-15(21)10-8-13/h1-2,5-10,14H,3-4,11-12H2,(H,22,24)
InChIKeySLWOPMLQWBJRCL-UHFFFAOYSA-N
MW360.82 g/mol
LogP3.97
Rot. Bonds3

About N-(2-chlorophenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide

N-(2-chlorophenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide (PubChem CID 51272015) has the molecular formula C19H18ClFN2O2 and a molecular weight of 360.82 g/mol. Its IUPAC name is N-(2-chlorophenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide
PubChem CID51272015
Molecular FormulaC19H18ClFN2O2
Molecular Weight360.82 g/mol
Exact Mass360.10
IUPAC NameN-(2-chlorophenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide
SMILESO=C(Nc1ccccc1Cl)C1CCCN(C(=O)c2ccc(F)cc2)C1
InChIInChI=1S/C19H18ClFN2O2/c20-16-5-1-2-6-17(16)22-18(24)14-4-3-11-23(12-14)19(25)13-7-9-15(21)10-8-13/h1-2,5-10,14H,3-4,11-12H2,(H,22,24)
InChIKeySLWOPMLQWBJRCL-UHFFFAOYSA-N
XLogP3.97
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.82
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,4-difluorophenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide
CID 51272463
1-(4-chlorobenzoyl)-N-[2-[(4-chlorobenzoyl)amino]phenyl]piperidine-3-carboxamide
CID 46439094
1-(4-fluorobenzoyl)-N-(2,3,4-trifluorophenyl)piperidine-3-carboxamide
CID 24534971
N-(5-chloro-2-methylphenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide
CID 46650461
N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide
CID 18267750
1-(4-fluorobenzoyl)-N-(2-prop-2-enylsulfanylphenyl)piperidine-3-carboxamide
CID 24535111
N-[2-(4-ethylpiperazin-1-yl)phenyl]-1-(4-fluorobenzoyl)piperidine-3-carboxamide
CID 24535038
1-(4-chlorobenzoyl)-N-(4-chloro-2-fluorophenyl)piperidine-3-carboxamide
CID 134062571
1-(4-fluorobenzoyl)piperidine-3-carbohydrazide
CID 54793956
1-(4-fluorobenzoyl)-N-methylpiperidine-3-carboxamide
CID 47128312
(3R)-N-(2-chlorophenyl)-1-(2,2-dimethylpropanoyl)piperidine-3-carboxamide
CID 94857586
(3S)-3-N-(2-chlorophenyl)-1-N-phenylpiperidine-1,3-dicarboxamide
CID 8865149

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide?
The IUPAC name of N-(2-chlorophenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide (CID 51272015) is N-(2-chlorophenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide.
What is the SMILES notation for N-(2-chlorophenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide?
The canonical SMILES for N-(2-chlorophenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide is O=C(Nc1ccccc1Cl)C1CCCN(C(=O)c2ccc(F)cc2)C1.
What is the InChIKey of N-(2-chlorophenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide?
The InChIKey is SLWOPMLQWBJRCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18ClFN2O2/c20-16-5-1-2-6-17(16)22-18(24)14-4-3-11-23(12-14)19(25)13-7-9-15(21)10-8-13/h1-2,5-10,14H,3-4,11-12H2,(H,22,24).
What are the key properties of N-(2-chlorophenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide?
N-(2-chlorophenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide has a molecular weight of 360.82 g/mol, XLogP of 3.97, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide is sourced from PubChem (CID 51272015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).