N-(2-methyl-3-naphthalen-1-ylpropyl)-1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide

C29H32N4O2 — CID 43929375

IUPACN-(2-methyl-3-naphthalen-1-ylpropyl)-1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide
SMILESCC(CNC(=O)C1CCCN(Cc2nc(-c3ccccc3)no2)C1)Cc1cccc2ccccc12
InChIInChI=1S/C29H32N4O2/c1-21(17-24-13-7-12-22-9-5-6-15-26(22)24)18-30-29(34)25-14-8-16-33(19-25)20-27-31-28(32-35-27)23-10-3-2-4-11-23/h2-7,9-13,15,21,25H,8,14,16-20H2,1H3,(H,30,34)
InChIKeyZWGHZMLXDTYPIG-UHFFFAOYSA-N
MW468.60 g/mol
LogP5.10
Rot. Bonds8

About N-(2-methyl-3-naphthalen-1-ylpropyl)-1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide

N-(2-methyl-3-naphthalen-1-ylpropyl)-1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide (PubChem CID 43929375) has the molecular formula C29H32N4O2 and a molecular weight of 468.60 g/mol. Its IUPAC name is N-(2-methyl-3-naphthalen-1-ylpropyl)-1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide.

Molecular Properties

Compound NameN-(2-methyl-3-naphthalen-1-ylpropyl)-1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide
PubChem CID43929375
Molecular FormulaC29H32N4O2
Molecular Weight468.60 g/mol
Exact Mass468.25
IUPAC NameN-(2-methyl-3-naphthalen-1-ylpropyl)-1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide
SMILESCC(CNC(=O)C1CCCN(Cc2nc(-c3ccccc3)no2)C1)Cc1cccc2ccccc12
InChIInChI=1S/C29H32N4O2/c1-21(17-24-13-7-12-22-9-5-6-15-26(22)24)18-30-29(34)25-14-8-16-33(19-25)20-27-31-28(32-35-27)23-10-3-2-4-11-23/h2-7,9-13,15,21,25H,8,14,16-20H2,1H3,(H,30,34)
InChIKeyZWGHZMLXDTYPIG-UHFFFAOYSA-N
XLogP5.10
TPSA71.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500468.60
LogP ≤ 55.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(2-methyl-3-naphthalen-1-ylpropyl)-1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]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-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-(2-methyl-3-naphthalen-1-ylpropyl)piperidine-4-carboxamide
CID 43928164
1-[[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-(2-methyl-3-naphthalen-1-ylpropyl)piperidine-4-carboxamide
CID 43927512
(3S)-N-(cyclopropylmethyl)-1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide
CID 94028331
(3R)-N-(cyclopropylmethyl)-1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide
CID 94028332
1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]-N-[(4-propan-2-yloxyphenyl)methyl]piperidine-3-carboxamide
CID 43929323
N-phenyl-1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide
CID 43929041
N-[(2-methylphenyl)methyl]-1-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidine-3-carboxamide
CID 43929942
1-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-(2-phenylethyl)piperidine-3-carboxamide
CID 43930308
N-[2-(4-methylphenyl)sulfanylethyl]-1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide
CID 43929086
1-[[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-(2-methylpropyl)piperidine-3-carboxamide
CID 43933632
N-(2-benzylsulfanylethyl)-1-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidine-3-carboxamide
CID 43930359
N-[[2-(2-methylimidazol-1-yl)phenyl]methyl]-1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide
CID 43929325

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-3-naphthalen-1-ylpropyl)-1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide?
The IUPAC name of N-(2-methyl-3-naphthalen-1-ylpropyl)-1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide (CID 43929375) is N-(2-methyl-3-naphthalen-1-ylpropyl)-1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide.
What is the SMILES notation for N-(2-methyl-3-naphthalen-1-ylpropyl)-1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide?
The canonical SMILES for N-(2-methyl-3-naphthalen-1-ylpropyl)-1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide is CC(CNC(=O)C1CCCN(Cc2nc(-c3ccccc3)no2)C1)Cc1cccc2ccccc12.
What is the InChIKey of N-(2-methyl-3-naphthalen-1-ylpropyl)-1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide?
The InChIKey is ZWGHZMLXDTYPIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H32N4O2/c1-21(17-24-13-7-12-22-9-5-6-15-26(22)24)18-30-29(34)25-14-8-16-33(19-25)20-27-31-28(32-35-27)23-10-3-2-4-11-23/h2-7,9-13,15,21,25H,8,14,16-20H2,1H3,(H,30,34).
What are the key properties of N-(2-methyl-3-naphthalen-1-ylpropyl)-1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide?
N-(2-methyl-3-naphthalen-1-ylpropyl)-1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide has a molecular weight of 468.60 g/mol, XLogP of 5.10, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-3-naphthalen-1-ylpropyl)-1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carboxamide is sourced from PubChem (CID 43929375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).