1-[(3,5-difluorophenyl)methyl]-N-[2-(4-methoxyphenyl)phenyl]piperidine-3-carboxamide

C26H26F2N2O2 — CID 45169697

IUPAC1-[(3,5-difluorophenyl)methyl]-N-[2-(4-methoxyphenyl)phenyl]piperidine-3-carboxamide
SMILESCOc1ccc(-c2ccccc2NC(=O)C2CCCN(Cc3cc(F)cc(F)c3)C2)cc1
InChIInChI=1S/C26H26F2N2O2/c1-32-23-10-8-19(9-11-23)24-6-2-3-7-25(24)29-26(31)20-5-4-12-30(17-20)16-18-13-21(27)15-22(28)14-18/h2-3,6-11,13-15,20H,4-5,12,16-17H2,1H3,(H,29,31)
InChIKeyFAEQBDQAOFCDFX-UHFFFAOYSA-N
MW436.50 g/mol
LogP5.49
Rot. Bonds6

About 1-[(3,5-difluorophenyl)methyl]-N-[2-(4-methoxyphenyl)phenyl]piperidine-3-carboxamide

1-[(3,5-difluorophenyl)methyl]-N-[2-(4-methoxyphenyl)phenyl]piperidine-3-carboxamide (PubChem CID 45169697) has the molecular formula C26H26F2N2O2 and a molecular weight of 436.50 g/mol. Its IUPAC name is 1-[(3,5-difluorophenyl)methyl]-N-[2-(4-methoxyphenyl)phenyl]piperidine-3-carboxamide.

Molecular Properties

Compound Name1-[(3,5-difluorophenyl)methyl]-N-[2-(4-methoxyphenyl)phenyl]piperidine-3-carboxamide
PubChem CID45169697
Molecular FormulaC26H26F2N2O2
Molecular Weight436.50 g/mol
Exact Mass436.20
IUPAC Name1-[(3,5-difluorophenyl)methyl]-N-[2-(4-methoxyphenyl)phenyl]piperidine-3-carboxamide
SMILESCOc1ccc(-c2ccccc2NC(=O)C2CCCN(Cc3cc(F)cc(F)c3)C2)cc1
InChIInChI=1S/C26H26F2N2O2/c1-32-23-10-8-19(9-11-23)24-6-2-3-7-25(24)29-26(31)20-5-4-12-30(17-20)16-18-13-21(27)15-22(28)14-18/h2-3,6-11,13-15,20H,4-5,12,16-17H2,1H3,(H,29,31)
InChIKeyFAEQBDQAOFCDFX-UHFFFAOYSA-N
XLogP5.49
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500436.50
LogP ≤ 55.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[(3,5-difluorophenyl)methyl]-N-[2-(4-methoxyphenyl)phenyl]piperidine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[(3-chloro-4-hydroxyphenyl)methyl]-N-[2-(4-methoxyphenyl)phenyl]piperidine-3-carboxamide
CID 45184860
1-(cyclopropylmethyl)-N-[2-(4-methoxyphenyl)phenyl]piperidine-3-carboxamide
CID 56857067
N-[2-(4-methoxyphenyl)phenyl]-1-(1H-pyrazol-5-ylmethyl)piperidine-3-carboxamide
CID 45186640
N-[2-(4-methoxyphenyl)phenyl]-1-[(E)-2-methylbut-2-enyl]piperidine-3-carboxamide
CID 45247760
(3S)-N-[2-(4-methoxyphenyl)phenyl]-1-[(2-methyl-1H-imidazol-5-yl)methyl]piperidine-3-carboxamide
CID 42596442
(3R)-1-[(4-fluorophenyl)methyl]-N-(2-methoxyphenyl)piperidine-3-carboxamide
CID 93490919
N-(2,5-dimethoxyphenyl)-1-[(4-fluorophenyl)methyl]piperidine-3-carboxamide
CID 43920049
N-[2-(4-methoxyphenyl)phenyl]-1-pentan-3-ylpiperidine-3-carboxamide
CID 45243690
(3R)-1-[(4-fluorophenyl)methyl]-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]piperidine-3-carboxamide
CID 100736674
N-[2-(4-methoxyphenyl)phenyl]-1-(thian-4-yl)piperidine-3-carboxamide
CID 45228808
N-(2-fluorophenyl)-1-[(4-methylphenyl)methyl]piperidine-3-carboxamide
CID 43921368
N-(2-aminophenyl)-1-[(3-fluorophenyl)methyl]piperidine-3-carboxamide;dihydrochloride
CID 119422659

Frequently Asked Questions

What is the IUPAC name of 1-[(3,5-difluorophenyl)methyl]-N-[2-(4-methoxyphenyl)phenyl]piperidine-3-carboxamide?
The IUPAC name of 1-[(3,5-difluorophenyl)methyl]-N-[2-(4-methoxyphenyl)phenyl]piperidine-3-carboxamide (CID 45169697) is 1-[(3,5-difluorophenyl)methyl]-N-[2-(4-methoxyphenyl)phenyl]piperidine-3-carboxamide.
What is the SMILES notation for 1-[(3,5-difluorophenyl)methyl]-N-[2-(4-methoxyphenyl)phenyl]piperidine-3-carboxamide?
The canonical SMILES for 1-[(3,5-difluorophenyl)methyl]-N-[2-(4-methoxyphenyl)phenyl]piperidine-3-carboxamide is COc1ccc(-c2ccccc2NC(=O)C2CCCN(Cc3cc(F)cc(F)c3)C2)cc1.
What is the InChIKey of 1-[(3,5-difluorophenyl)methyl]-N-[2-(4-methoxyphenyl)phenyl]piperidine-3-carboxamide?
The InChIKey is FAEQBDQAOFCDFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26F2N2O2/c1-32-23-10-8-19(9-11-23)24-6-2-3-7-25(24)29-26(31)20-5-4-12-30(17-20)16-18-13-21(27)15-22(28)14-18/h2-3,6-11,13-15,20H,4-5,12,16-17H2,1H3,(H,29,31).
What are the key properties of 1-[(3,5-difluorophenyl)methyl]-N-[2-(4-methoxyphenyl)phenyl]piperidine-3-carboxamide?
1-[(3,5-difluorophenyl)methyl]-N-[2-(4-methoxyphenyl)phenyl]piperidine-3-carboxamide has a molecular weight of 436.50 g/mol, XLogP of 5.49, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3,5-difluorophenyl)methyl]-N-[2-(4-methoxyphenyl)phenyl]piperidine-3-carboxamide is sourced from PubChem (CID 45169697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).