(3R)-N,N-diethyl-1-(naphthalen-2-ylmethyl)piperidine-3-carboxamide

C21H28N2O — CID 764273

IUPAC(3R)-N,N-diethyl-1-(naphthalen-2-ylmethyl)piperidine-3-carboxamide
SMILESCCN(CC)C(=O)[C@@H]1CCCN(Cc2ccc3ccccc3c2)C1
InChIInChI=1S/C21H28N2O/c1-3-23(4-2)21(24)20-10-7-13-22(16-20)15-17-11-12-18-8-5-6-9-19(18)14-17/h5-6,8-9,11-12,14,20H,3-4,7,10,13,15-16H2,1-2H3/t20-/m1/s1
InChIKeyXYQBXOHRHLJLIU-HXUWFJFHSA-N
MW324.47 g/mol
LogP3.92
Rot. Bonds5

About (3R)-N,N-diethyl-1-(naphthalen-2-ylmethyl)piperidine-3-carboxamide

(3R)-N,N-diethyl-1-(naphthalen-2-ylmethyl)piperidine-3-carboxamide (PubChem CID 764273) has the molecular formula C21H28N2O and a molecular weight of 324.47 g/mol. Its IUPAC name is (3R)-N,N-diethyl-1-(naphthalen-2-ylmethyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-N,N-diethyl-1-(naphthalen-2-ylmethyl)piperidine-3-carboxamide
PubChem CID764273
Molecular FormulaC21H28N2O
Molecular Weight324.47 g/mol
Exact Mass324.22
IUPAC Name(3R)-N,N-diethyl-1-(naphthalen-2-ylmethyl)piperidine-3-carboxamide
SMILESCCN(CC)C(=O)[C@@H]1CCCN(Cc2ccc3ccccc3c2)C1
InChIInChI=1S/C21H28N2O/c1-3-23(4-2)21(24)20-10-7-13-22(16-20)15-17-11-12-18-8-5-6-9-19(18)14-17/h5-6,8-9,11-12,14,20H,3-4,7,10,13,15-16H2,1-2H3/t20-/m1/s1
InChIKeyXYQBXOHRHLJLIU-HXUWFJFHSA-N
XLogP3.92
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.47
LogP ≤ 53.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze (3R)-N,N-diethyl-1-(naphthalen-2-ylmethyl)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

(3R)-1-[[4-[[(3R)-3-(diethylcarbamoyl)piperidin-1-yl]methyl]phenyl]methyl]-N,N-diethylpiperidine-3-carboxamide;dihydrobromide
CID 3072460
1-[(3,4-difluorophenyl)methyl]-N,N-diethylpiperidine-3-carboxamide
CID 2838224
(3S)-N,N-diethyl-1-[(4-methylphenyl)methyl]piperidine-3-carboxamide
CID 1377142
N-benzyl-1-[[4-[[3-[benzyl(ethyl)carbamoyl]piperidin-1-yl]methyl]phenyl]methyl]-N-ethylpiperidine-3-carboxamide;hydrobromide
CID 67856003
(3R)-N,N-diethyl-1-[(4-hydroxy-3-methoxyphenyl)methyl]piperidine-3-carboxamide
CID 40501214
(3R)-N,N-diethyl-1-(pyridin-4-ylmethyl)piperidine-3-carboxamide
CID 26457997
(3S)-1-[(3-ethoxy-4-hydroxyphenyl)methyl]-N,N-diethylpiperidine-3-carboxamide
CID 765858
1-benzyl-N-ethyl-N-(2-hydroxy-2-methylpropyl)piperidine-3-carboxamide
CID 136512107
(3S)-N,N-diethyl-1-(furan-2-ylmethyl)piperidine-3-carboxamide
CID 764291
(3R)-1-[(2,5-dimethylphenyl)methyl]-N,N-diethylpiperidine-3-carboxamide
CID 2057088
(3S)-N,N-diethyl-1-[[4-[(3-hydroxy-4-methoxyphenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]piperidine-3-carboxamide
CID 42321691
N,N-diethyl-1-[[3-[2-(2-oxopyrrolidin-1-yl)ethoxy]phenyl]methyl]piperidine-3-carboxamide
CID 171911041

Frequently Asked Questions

What is the IUPAC name of (3R)-N,N-diethyl-1-(naphthalen-2-ylmethyl)piperidine-3-carboxamide?
The IUPAC name of (3R)-N,N-diethyl-1-(naphthalen-2-ylmethyl)piperidine-3-carboxamide (CID 764273) is (3R)-N,N-diethyl-1-(naphthalen-2-ylmethyl)piperidine-3-carboxamide.
What is the SMILES notation for (3R)-N,N-diethyl-1-(naphthalen-2-ylmethyl)piperidine-3-carboxamide?
The canonical SMILES for (3R)-N,N-diethyl-1-(naphthalen-2-ylmethyl)piperidine-3-carboxamide is CCN(CC)C(=O)[C@@H]1CCCN(Cc2ccc3ccccc3c2)C1.
What is the InChIKey of (3R)-N,N-diethyl-1-(naphthalen-2-ylmethyl)piperidine-3-carboxamide?
The InChIKey is XYQBXOHRHLJLIU-HXUWFJFHSA-N. The full InChI is InChI=1S/C21H28N2O/c1-3-23(4-2)21(24)20-10-7-13-22(16-20)15-17-11-12-18-8-5-6-9-19(18)14-17/h5-6,8-9,11-12,14,20H,3-4,7,10,13,15-16H2,1-2H3/t20-/m1/s1.
What are the key properties of (3R)-N,N-diethyl-1-(naphthalen-2-ylmethyl)piperidine-3-carboxamide?
(3R)-N,N-diethyl-1-(naphthalen-2-ylmethyl)piperidine-3-carboxamide has a molecular weight of 324.47 g/mol, XLogP of 3.92, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N,N-diethyl-1-(naphthalen-2-ylmethyl)piperidine-3-carboxamide is sourced from PubChem (CID 764273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).