N-benzyl-3-[1-(2,2-dimethylpropyl)piperidin-4-yl]oxybenzamide

C24H32N2O2 — CID 42526081

IUPACN-benzyl-3-[1-(2,2-dimethylpropyl)piperidin-4-yl]oxybenzamide
SMILESCC(C)(C)CN1CCC(Oc2cccc(C(=O)NCc3ccccc3)c2)CC1
InChIInChI=1S/C24H32N2O2/c1-24(2,3)18-26-14-12-21(13-15-26)28-22-11-7-10-20(16-22)23(27)25-17-19-8-5-4-6-9-19/h4-11,16,21H,12-15,17-18H2,1-3H3,(H,25,27)
InChIKeyJLFOXJORPGWKNM-UHFFFAOYSA-N
MW380.53 g/mol
LogP4.51
Rot. Bonds6

About N-benzyl-3-[1-(2,2-dimethylpropyl)piperidin-4-yl]oxybenzamide

N-benzyl-3-[1-(2,2-dimethylpropyl)piperidin-4-yl]oxybenzamide (PubChem CID 42526081) has the molecular formula C24H32N2O2 and a molecular weight of 380.53 g/mol. Its IUPAC name is N-benzyl-3-[1-(2,2-dimethylpropyl)piperidin-4-yl]oxybenzamide.

Molecular Properties

Compound NameN-benzyl-3-[1-(2,2-dimethylpropyl)piperidin-4-yl]oxybenzamide
PubChem CID42526081
Molecular FormulaC24H32N2O2
Molecular Weight380.53 g/mol
Exact Mass380.25
IUPAC NameN-benzyl-3-[1-(2,2-dimethylpropyl)piperidin-4-yl]oxybenzamide
SMILESCC(C)(C)CN1CCC(Oc2cccc(C(=O)NCc3ccccc3)c2)CC1
InChIInChI=1S/C24H32N2O2/c1-24(2,3)18-26-14-12-21(13-15-26)28-22-11-7-10-20(16-22)23(27)25-17-19-8-5-4-6-9-19/h4-11,16,21H,12-15,17-18H2,1-3H3,(H,25,27)
InChIKeyJLFOXJORPGWKNM-UHFFFAOYSA-N
XLogP4.51
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.53
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-benzyl-3-[1-(2,2-dimethylpropyl)piperidin-4-yl]oxybenzamide 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

N-benzyl-3-[1-[(2R)-4,4,4-trifluorobutan-2-yl]piperidin-4-yl]oxybenzamide
CID 42147497
N-benzyl-3-(1-but-3-enoylpiperidin-4-yl)oxybenzamide
CID 28957115
3-[1-(2,2-dimethylpropyl)piperidin-4-yl]oxy-N-[(4-fluorophenyl)methyl]-N-methylbenzamide
CID 42383715
N-[3-(benzylcarbamoyl)phenyl]-4-[3-(trifluoromethyl)phenoxy]piperidine-1-carboxamide
CID 145485865
[3-[1-(2,2-dimethylpropyl)piperidin-4-yl]oxyphenyl]-[(3S)-3-(hydroxymethyl)piperidin-1-yl]methanone
CID 42343229
3-[1-[(1,5-dimethylpyrazol-4-yl)methyl]piperidin-4-yl]oxy-N-(pyridin-3-ylmethyl)benzamide
CID 42557626
[3-[1-(2,2-dimethylpropyl)piperidin-4-yl]oxyphenyl]-[(2R)-2-(2-methoxyethyl)piperidin-1-yl]methanone
CID 25303632
N-(pyridin-3-ylmethyl)-3-[1-(thiophen-3-ylmethyl)piperidin-4-yl]oxybenzamide
CID 42462930
3-[1-(cyclohexylmethyl)piperidin-4-yl]oxy-N-(2-methoxyethyl)benzamide
CID 42216218
2-benzyl-N-[[3-(1-methylpiperidin-4-yl)oxyphenyl]methyl]benzamide
CID 69193811
N-benzyl-3-(trifluoromethoxy)benzamide
CID 175307745
N-benzyl-3-[(4-benzylpiperidin-1-yl)methyl]benzamide
CID 42850884

Frequently Asked Questions

What is the IUPAC name of N-benzyl-3-[1-(2,2-dimethylpropyl)piperidin-4-yl]oxybenzamide?
The IUPAC name of N-benzyl-3-[1-(2,2-dimethylpropyl)piperidin-4-yl]oxybenzamide (CID 42526081) is N-benzyl-3-[1-(2,2-dimethylpropyl)piperidin-4-yl]oxybenzamide.
What is the SMILES notation for N-benzyl-3-[1-(2,2-dimethylpropyl)piperidin-4-yl]oxybenzamide?
The canonical SMILES for N-benzyl-3-[1-(2,2-dimethylpropyl)piperidin-4-yl]oxybenzamide is CC(C)(C)CN1CCC(Oc2cccc(C(=O)NCc3ccccc3)c2)CC1.
What is the InChIKey of N-benzyl-3-[1-(2,2-dimethylpropyl)piperidin-4-yl]oxybenzamide?
The InChIKey is JLFOXJORPGWKNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H32N2O2/c1-24(2,3)18-26-14-12-21(13-15-26)28-22-11-7-10-20(16-22)23(27)25-17-19-8-5-4-6-9-19/h4-11,16,21H,12-15,17-18H2,1-3H3,(H,25,27).
What are the key properties of N-benzyl-3-[1-(2,2-dimethylpropyl)piperidin-4-yl]oxybenzamide?
N-benzyl-3-[1-(2,2-dimethylpropyl)piperidin-4-yl]oxybenzamide has a molecular weight of 380.53 g/mol, XLogP of 4.51, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-3-[1-(2,2-dimethylpropyl)piperidin-4-yl]oxybenzamide is sourced from PubChem (CID 42526081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).