N-[[(3S)-1-ethylpiperidin-3-yl]methyl]-2-phenylmethoxyacetamide

C17H26N2O2 — CID 94809340

IUPACN-[[(3S)-1-ethylpiperidin-3-yl]methyl]-2-phenylmethoxyacetamide
SMILESCCN1CCC[C@@H](CNC(=O)COCc2ccccc2)C1
InChIInChI=1S/C17H26N2O2/c1-2-19-10-6-9-16(12-19)11-18-17(20)14-21-13-15-7-4-3-5-8-15/h3-5,7-8,16H,2,6,9-14H2,1H3,(H,18,20)/t16-/m0/s1
InChIKeyGPDVLDAQSNNALT-INIZCTEOSA-N
MW290.41 g/mol
LogP2.05
Rot. Bonds7

About N-[[(3S)-1-ethylpiperidin-3-yl]methyl]-2-phenylmethoxyacetamide

N-[[(3S)-1-ethylpiperidin-3-yl]methyl]-2-phenylmethoxyacetamide (PubChem CID 94809340) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-[[(3S)-1-ethylpiperidin-3-yl]methyl]-2-phenylmethoxyacetamide.

Molecular Properties

Compound NameN-[[(3S)-1-ethylpiperidin-3-yl]methyl]-2-phenylmethoxyacetamide
PubChem CID94809340
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC NameN-[[(3S)-1-ethylpiperidin-3-yl]methyl]-2-phenylmethoxyacetamide
SMILESCCN1CCC[C@@H](CNC(=O)COCc2ccccc2)C1
InChIInChI=1S/C17H26N2O2/c1-2-19-10-6-9-16(12-19)11-18-17(20)14-21-13-15-7-4-3-5-8-15/h3-5,7-8,16H,2,6,9-14H2,1H3,(H,18,20)/t16-/m0/s1
InChIKeyGPDVLDAQSNNALT-INIZCTEOSA-N
XLogP2.05
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[[(3S)-1-ethylpiperidin-3-yl]methyl]-2-phenylmethoxyacetamide 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-[[(3R)-1-ethylpiperidin-3-yl]methyl]-2-phenylmethoxyacetamide
CID 94809339
4-ethyl-N-[[(3R)-1-(2-phenylethyl)piperidin-3-yl]methyl]piperazine-1-carboxamide
CID 126426505
2-amino-N-[[(3S)-1-benzylpiperidin-3-yl]methyl]acetamide
CID 96553013
1-[3-(methylaminomethyl)piperidin-1-yl]-2-phenylmethoxyethanone
CID 119396607
2-cyclopentyl-N-[(1-ethylpiperidin-3-yl)methyl]acetamide
CID 75418465
N-[(1-benzylpiperidin-3-yl)methyl]acetamide
CID 10444612
N-[[(3R)-1-benzylpiperidin-3-yl]methyl]-4-(2-methoxyethoxy)butanamide
CID 95186738
(2R)-2-benzyl-N-[[(3R)-1-ethylpiperidin-3-yl]methyl]morpholine-4-carboxamide
CID 97337261
3-(1,3-benzothiazol-2-yl)-N-[[(3R)-1-ethylpiperidin-3-yl]methyl]propanamide
CID 94810927
1-[3-(methylaminomethyl)piperidin-1-yl]-2-phenylmethoxyethanone;hydrochloride
CID 119396606
benzyl N-[[(3R)-1-(2-aminoethyl)piperidin-3-yl]methyl]carbamate
CID 96553888
benzyl (3R)-3-[[(2-aminoacetyl)amino]methyl]piperidine-1-carboxylate
CID 96552603

Frequently Asked Questions

What is the IUPAC name of N-[[(3S)-1-ethylpiperidin-3-yl]methyl]-2-phenylmethoxyacetamide?
The IUPAC name of N-[[(3S)-1-ethylpiperidin-3-yl]methyl]-2-phenylmethoxyacetamide (CID 94809340) is N-[[(3S)-1-ethylpiperidin-3-yl]methyl]-2-phenylmethoxyacetamide.
What is the SMILES notation for N-[[(3S)-1-ethylpiperidin-3-yl]methyl]-2-phenylmethoxyacetamide?
The canonical SMILES for N-[[(3S)-1-ethylpiperidin-3-yl]methyl]-2-phenylmethoxyacetamide is CCN1CCC[C@@H](CNC(=O)COCc2ccccc2)C1.
What is the InChIKey of N-[[(3S)-1-ethylpiperidin-3-yl]methyl]-2-phenylmethoxyacetamide?
The InChIKey is GPDVLDAQSNNALT-INIZCTEOSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-2-19-10-6-9-16(12-19)11-18-17(20)14-21-13-15-7-4-3-5-8-15/h3-5,7-8,16H,2,6,9-14H2,1H3,(H,18,20)/t16-/m0/s1.
What are the key properties of N-[[(3S)-1-ethylpiperidin-3-yl]methyl]-2-phenylmethoxyacetamide?
N-[[(3S)-1-ethylpiperidin-3-yl]methyl]-2-phenylmethoxyacetamide has a molecular weight of 290.41 g/mol, XLogP of 2.05, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(3S)-1-ethylpiperidin-3-yl]methyl]-2-phenylmethoxyacetamide is sourced from PubChem (CID 94809340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).