N-(3,5-dichlorophenyl)-1-phenylpiperidine-4-carboxamide

C18H18Cl2N2O — CID 17152302

IUPACN-(3,5-dichlorophenyl)-1-phenylpiperidine-4-carboxamide
SMILESO=C(Nc1cc(Cl)cc(Cl)c1)C1CCN(c2ccccc2)CC1
InChIInChI=1S/C18H18Cl2N2O/c19-14-10-15(20)12-16(11-14)21-18(23)13-6-8-22(9-7-13)17-4-2-1-3-5-17/h1-5,10-13H,6-9H2,(H,21,23)
InChIKeyDFYQHWGBESVCHD-UHFFFAOYSA-N
MW349.26 g/mol
LogP4.85
Rot. Bonds3

About N-(3,5-dichlorophenyl)-1-phenylpiperidine-4-carboxamide

N-(3,5-dichlorophenyl)-1-phenylpiperidine-4-carboxamide (PubChem CID 17152302) has the molecular formula C18H18Cl2N2O and a molecular weight of 349.26 g/mol. Its IUPAC name is N-(3,5-dichlorophenyl)-1-phenylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-(3,5-dichlorophenyl)-1-phenylpiperidine-4-carboxamide
PubChem CID17152302
Molecular FormulaC18H18Cl2N2O
Molecular Weight349.26 g/mol
Exact Mass348.08
IUPAC NameN-(3,5-dichlorophenyl)-1-phenylpiperidine-4-carboxamide
SMILESO=C(Nc1cc(Cl)cc(Cl)c1)C1CCN(c2ccccc2)CC1
InChIInChI=1S/C18H18Cl2N2O/c19-14-10-15(20)12-16(11-14)21-18(23)13-6-8-22(9-7-13)17-4-2-1-3-5-17/h1-5,10-13H,6-9H2,(H,21,23)
InChIKeyDFYQHWGBESVCHD-UHFFFAOYSA-N
XLogP4.85
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.26
LogP ≤ 54.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-phenyl-N-(2,4,5-trichlorophenyl)piperidine-4-carboxamide
CID 17152279
N-[2-chloro-5-(trifluoromethyl)phenyl]-1-phenylpiperidine-4-carboxamide
CID 17152284
N-(5-chloro-2-methoxyphenyl)-1-phenylpiperidine-4-carboxamide
CID 17152311
(3R)-N-(3,5-dichlorophenyl)-5-oxo-1-phenylpyrrolidine-3-carboxamide
CID 40569713
1-(3-chlorophenyl)-N-(4-propan-2-ylphenyl)piperidine-4-carboxamide
CID 17153034
N-(4-chloro-2,5-dimethoxyphenyl)-1-phenylpiperidine-4-carboxamide
CID 17152391
N-(2,6-dimethylphenyl)-1-phenylpiperidine-4-carboxamide
CID 17152337
1-(3-chlorophenyl)-N-(4-methoxyphenyl)piperidine-4-carboxamide
CID 17152909
methyl 4-[(3,5-dichlorophenyl)carbamoyl]piperidine-1-carboxylate
CID 110754243
N-[(4-chlorophenyl)methyl]-1-phenylpiperidine-4-carboxamide
CID 17152448
N-(3,5-dichlorophenyl)-1-methylpyrrolidine-3-carboxamide
CID 110864208
N-(2,4-dimethylphenyl)-1-phenylpiperidine-4-carboxamide
CID 17152381

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dichlorophenyl)-1-phenylpiperidine-4-carboxamide?
The IUPAC name of N-(3,5-dichlorophenyl)-1-phenylpiperidine-4-carboxamide (CID 17152302) is N-(3,5-dichlorophenyl)-1-phenylpiperidine-4-carboxamide.
What is the SMILES notation for N-(3,5-dichlorophenyl)-1-phenylpiperidine-4-carboxamide?
The canonical SMILES for N-(3,5-dichlorophenyl)-1-phenylpiperidine-4-carboxamide is O=C(Nc1cc(Cl)cc(Cl)c1)C1CCN(c2ccccc2)CC1.
What is the InChIKey of N-(3,5-dichlorophenyl)-1-phenylpiperidine-4-carboxamide?
The InChIKey is DFYQHWGBESVCHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18Cl2N2O/c19-14-10-15(20)12-16(11-14)21-18(23)13-6-8-22(9-7-13)17-4-2-1-3-5-17/h1-5,10-13H,6-9H2,(H,21,23).
What are the key properties of N-(3,5-dichlorophenyl)-1-phenylpiperidine-4-carboxamide?
N-(3,5-dichlorophenyl)-1-phenylpiperidine-4-carboxamide has a molecular weight of 349.26 g/mol, XLogP of 4.85, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dichlorophenyl)-1-phenylpiperidine-4-carboxamide is sourced from PubChem (CID 17152302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).