1-benzyl-N-(4-phenylmethoxyphenyl)piperidine-3-carboxamide

C26H28N2O2 — CID 43922210

IUPAC1-benzyl-N-(4-phenylmethoxyphenyl)piperidine-3-carboxamide
SMILESO=C(Nc1ccc(OCc2ccccc2)cc1)C1CCCN(Cc2ccccc2)C1
InChIInChI=1S/C26H28N2O2/c29-26(23-12-7-17-28(19-23)18-21-8-3-1-4-9-21)27-24-13-15-25(16-14-24)30-20-22-10-5-2-6-11-22/h1-6,8-11,13-16,23H,7,12,17-20H2,(H,27,29)
InChIKeyDGOBXQBYJDVBCB-UHFFFAOYSA-N
MW400.52 g/mol
LogP5.12
Rot. Bonds7

About 1-benzyl-N-(4-phenylmethoxyphenyl)piperidine-3-carboxamide

1-benzyl-N-(4-phenylmethoxyphenyl)piperidine-3-carboxamide (PubChem CID 43922210) has the molecular formula C26H28N2O2 and a molecular weight of 400.52 g/mol. Its IUPAC name is 1-benzyl-N-(4-phenylmethoxyphenyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name1-benzyl-N-(4-phenylmethoxyphenyl)piperidine-3-carboxamide
PubChem CID43922210
Molecular FormulaC26H28N2O2
Molecular Weight400.52 g/mol
Exact Mass400.22
IUPAC Name1-benzyl-N-(4-phenylmethoxyphenyl)piperidine-3-carboxamide
SMILESO=C(Nc1ccc(OCc2ccccc2)cc1)C1CCCN(Cc2ccccc2)C1
InChIInChI=1S/C26H28N2O2/c29-26(23-12-7-17-28(19-23)18-21-8-3-1-4-9-21)27-24-13-15-25(16-14-24)30-20-22-10-5-2-6-11-22/h1-6,8-11,13-16,23H,7,12,17-20H2,(H,27,29)
InChIKeyDGOBXQBYJDVBCB-UHFFFAOYSA-N
XLogP5.12
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500400.52
LogP ≤ 55.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-benzyl-N-(4-phenylmethoxyphenyl)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

(3S)-1-[(2-chlorophenyl)methyl]-N-(4-phenylmethoxyphenyl)piperidine-3-carboxamide
CID 93491646
1-benzyl-N-(4-phenoxyphenyl)piperidine-3-carboxamide
CID 43919796
(3S)-1-benzyl-N-(4-phenoxyphenyl)piperidine-3-carboxamide
CID 93490714
1-benzyl-N-(4-propan-2-yloxyphenyl)piperidine-3-carboxamide
CID 43925293
1-benzyl-N-(3,4-dichlorophenyl)piperidine-3-carboxamide
CID 43925060
1-benzyl-N-[3-(phenylcarbamoylamino)phenyl]piperidine-3-carboxamide
CID 47074842
ethyl 1-[(4-phenylmethoxyphenyl)methyl]piperidine-3-carboxylate
CID 2846092
1-[(2-chlorophenyl)methyl]-N-(4-ethoxyphenyl)piperidine-3-carboxamide
CID 43919760
(3S)-1-benzyl-N-(3,4-dimethylphenyl)piperidine-3-carboxamide
CID 93490442
1-[(2-chlorophenyl)methyl]-N-(4-phenylmethoxyphenyl)piperidine-4-carboxamide
CID 45014267
N-(4-phenylmethoxyphenyl)-1-(3-phenylpropylsulfonyl)piperidine-3-carboxamide
CID 43916267
(3S)-1-[[1-(3-bromophenyl)benzimidazol-2-yl]methyl]-N-(4-phenylmethoxyphenyl)piperidine-3-carboxamide
CID 124785566

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-N-(4-phenylmethoxyphenyl)piperidine-3-carboxamide?
The IUPAC name of 1-benzyl-N-(4-phenylmethoxyphenyl)piperidine-3-carboxamide (CID 43922210) is 1-benzyl-N-(4-phenylmethoxyphenyl)piperidine-3-carboxamide.
What is the SMILES notation for 1-benzyl-N-(4-phenylmethoxyphenyl)piperidine-3-carboxamide?
The canonical SMILES for 1-benzyl-N-(4-phenylmethoxyphenyl)piperidine-3-carboxamide is O=C(Nc1ccc(OCc2ccccc2)cc1)C1CCCN(Cc2ccccc2)C1.
What is the InChIKey of 1-benzyl-N-(4-phenylmethoxyphenyl)piperidine-3-carboxamide?
The InChIKey is DGOBXQBYJDVBCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H28N2O2/c29-26(23-12-7-17-28(19-23)18-21-8-3-1-4-9-21)27-24-13-15-25(16-14-24)30-20-22-10-5-2-6-11-22/h1-6,8-11,13-16,23H,7,12,17-20H2,(H,27,29).
What are the key properties of 1-benzyl-N-(4-phenylmethoxyphenyl)piperidine-3-carboxamide?
1-benzyl-N-(4-phenylmethoxyphenyl)piperidine-3-carboxamide has a molecular weight of 400.52 g/mol, XLogP of 5.12, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-N-(4-phenylmethoxyphenyl)piperidine-3-carboxamide is sourced from PubChem (CID 43922210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).