N-(4-chlorophenyl)-1-(4-phenylbenzoyl)piperidine-4-carboxamide

C25H23ClN2O2 — CID 126071800

IUPACN-(4-chlorophenyl)-1-(4-phenylbenzoyl)piperidine-4-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1)C1CCN(C(=O)c2ccc(-c3ccccc3)cc2)CC1
InChIInChI=1S/C25H23ClN2O2/c26-22-10-12-23(13-11-22)27-24(29)20-14-16-28(17-15-20)25(30)21-8-6-19(7-9-21)18-4-2-1-3-5-18/h1-13,20H,14-17H2,(H,27,29)
InChIKeySBLZURKLLIBKDK-UHFFFAOYSA-N
MW418.92 g/mol
LogP5.50
Rot. Bonds4

About N-(4-chlorophenyl)-1-(4-phenylbenzoyl)piperidine-4-carboxamide

N-(4-chlorophenyl)-1-(4-phenylbenzoyl)piperidine-4-carboxamide (PubChem CID 126071800) has the molecular formula C25H23ClN2O2 and a molecular weight of 418.92 g/mol. Its IUPAC name is N-(4-chlorophenyl)-1-(4-phenylbenzoyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-1-(4-phenylbenzoyl)piperidine-4-carboxamide
PubChem CID126071800
Molecular FormulaC25H23ClN2O2
Molecular Weight418.92 g/mol
Exact Mass418.14
IUPAC NameN-(4-chlorophenyl)-1-(4-phenylbenzoyl)piperidine-4-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1)C1CCN(C(=O)c2ccc(-c3ccccc3)cc2)CC1
InChIInChI=1S/C25H23ClN2O2/c26-22-10-12-23(13-11-22)27-24(29)20-14-16-28(17-15-20)25(30)21-8-6-19(7-9-21)18-4-2-1-3-5-18/h1-13,20H,14-17H2,(H,27,29)
InChIKeySBLZURKLLIBKDK-UHFFFAOYSA-N
XLogP5.50
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500418.92
LogP ≤ 55.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3S)-1-(4-chlorobenzoyl)-N-(4-phenylphenyl)piperidine-3-carboxamide
CID 2542955
N-(4-phenylphenyl)-1-[4-(trifluoromethyl)benzoyl]piperidine-4-carboxamide
CID 46599278
4-[(1-benzoylpiperidine-4-carbonyl)amino]benzoic acid
CID 119177742
1-(4-chlorobenzoyl)-N-[4-(trifluoromethyl)phenyl]piperidine-4-carboxamide
CID 7961983
1-(3-chlorobenzoyl)-N-(4-chlorophenyl)piperidine-4-carboxamide
CID 113007193
1-(4-phenylbenzoyl)-N-(2,4,5-trichlorophenyl)piperidine-4-carboxamide
CID 126069700
1-(cyclopropanecarbonyl)-N-(4-phenylphenyl)piperidine-4-carboxamide
CID 51155668
4-[(4-chlorophenyl)carbamoyl]piperidine-1-carboxylic acid
CID 66651371
1-benzoyl-N-(4-pyrrolidin-1-ylphenyl)piperidine-4-carboxamide
CID 110298371
1-(4-tert-butylbenzoyl)-N-phenylpiperidine-4-carboxamide
CID 113006047
N-(3-nitrophenyl)-1-(4-phenylbenzoyl)piperidine-4-carboxamide
CID 1315418
1-[4-(benzenesulfonamido)benzoyl]-N-phenylpiperidine-4-carboxamide
CID 55410159

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-1-(4-phenylbenzoyl)piperidine-4-carboxamide?
The IUPAC name of N-(4-chlorophenyl)-1-(4-phenylbenzoyl)piperidine-4-carboxamide (CID 126071800) is N-(4-chlorophenyl)-1-(4-phenylbenzoyl)piperidine-4-carboxamide.
What is the SMILES notation for N-(4-chlorophenyl)-1-(4-phenylbenzoyl)piperidine-4-carboxamide?
The canonical SMILES for N-(4-chlorophenyl)-1-(4-phenylbenzoyl)piperidine-4-carboxamide is O=C(Nc1ccc(Cl)cc1)C1CCN(C(=O)c2ccc(-c3ccccc3)cc2)CC1.
What is the InChIKey of N-(4-chlorophenyl)-1-(4-phenylbenzoyl)piperidine-4-carboxamide?
The InChIKey is SBLZURKLLIBKDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23ClN2O2/c26-22-10-12-23(13-11-22)27-24(29)20-14-16-28(17-15-20)25(30)21-8-6-19(7-9-21)18-4-2-1-3-5-18/h1-13,20H,14-17H2,(H,27,29).
What are the key properties of N-(4-chlorophenyl)-1-(4-phenylbenzoyl)piperidine-4-carboxamide?
N-(4-chlorophenyl)-1-(4-phenylbenzoyl)piperidine-4-carboxamide has a molecular weight of 418.92 g/mol, XLogP of 5.50, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-1-(4-phenylbenzoyl)piperidine-4-carboxamide is sourced from PubChem (CID 126071800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).