N-[3-(4-hydroxypiperidin-1-yl)propyl]-2-naphthalen-2-yloxyacetamide

C20H26N2O3 — CID 111429697

IUPACN-[3-(4-hydroxypiperidin-1-yl)propyl]-2-naphthalen-2-yloxyacetamide
SMILESO=C(COc1ccc2ccccc2c1)NCCCN1CCC(O)CC1
InChIInChI=1S/C20H26N2O3/c23-18-8-12-22(13-9-18)11-3-10-21-20(24)15-25-19-7-6-16-4-1-2-5-17(16)14-19/h1-2,4-7,14,18,23H,3,8-13,15H2,(H,21,24)
InChIKeyZMEYGQGWFBDJRM-UHFFFAOYSA-N
MW342.44 g/mol
LogP2.18
Rot. Bonds7

About N-[3-(4-hydroxypiperidin-1-yl)propyl]-2-naphthalen-2-yloxyacetamide

N-[3-(4-hydroxypiperidin-1-yl)propyl]-2-naphthalen-2-yloxyacetamide (PubChem CID 111429697) has the molecular formula C20H26N2O3 and a molecular weight of 342.44 g/mol. Its IUPAC name is N-[3-(4-hydroxypiperidin-1-yl)propyl]-2-naphthalen-2-yloxyacetamide.

Molecular Properties

Compound NameN-[3-(4-hydroxypiperidin-1-yl)propyl]-2-naphthalen-2-yloxyacetamide
PubChem CID111429697
Molecular FormulaC20H26N2O3
Molecular Weight342.44 g/mol
Exact Mass342.19
IUPAC NameN-[3-(4-hydroxypiperidin-1-yl)propyl]-2-naphthalen-2-yloxyacetamide
SMILESO=C(COc1ccc2ccccc2c1)NCCCN1CCC(O)CC1
InChIInChI=1S/C20H26N2O3/c23-18-8-12-22(13-9-18)11-3-10-21-20(24)15-25-19-7-6-16-4-1-2-5-17(16)14-19/h1-2,4-7,14,18,23H,3,8-13,15H2,(H,21,24)
InChIKeyZMEYGQGWFBDJRM-UHFFFAOYSA-N
XLogP2.18
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.44
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[3-(4-hydroxypiperidin-1-yl)propyl]-2-(4-methylphenoxy)acetamide
CID 111429566
2-(4-chloro-3-methylphenoxy)-N-[3-(4-hydroxypiperidin-1-yl)propyl]acetamide
CID 111434042
N-[3-(4-hydroxypiperidin-1-yl)propyl]-2-naphthalen-1-ylacetamide
CID 111429650
N-(3-ethoxypropyl)-2-naphthalen-2-yloxyacetamide
CID 35292228
2-naphthalen-2-yloxy-N-[[(3S)-1-(2-phenylethyl)pyrrolidin-3-yl]methyl]acetamide
CID 97185415
2-naphthalen-2-yloxy-N-[2-(4-pyrrolidin-1-ylphenyl)ethyl]acetamide
CID 16889464
N-(2-acetamidoethyl)-2-naphthalen-2-yloxyacetamide
CID 7942082
2-naphthalen-2-yloxy-N-[3-(4-phenylpiperazin-1-yl)sulfonylpropyl]acetamide
CID 42175258
N-[3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonylpropyl]-2-naphthalen-2-yloxyacetamide
CID 42175402
2-naphthalen-2-yloxy-N-[2-(2-phenylmorpholin-4-yl)ethyl]acetamide
CID 16892396
2-(4-phenylmethoxyphenoxy)-N-(3-piperidin-1-ylpropyl)acetamide
CID 9405904
4-methyl-1-(4-naphthalen-2-yloxybutyl)piperidine;oxalic acid
CID 2888640

Frequently Asked Questions

What is the IUPAC name of N-[3-(4-hydroxypiperidin-1-yl)propyl]-2-naphthalen-2-yloxyacetamide?
The IUPAC name of N-[3-(4-hydroxypiperidin-1-yl)propyl]-2-naphthalen-2-yloxyacetamide (CID 111429697) is N-[3-(4-hydroxypiperidin-1-yl)propyl]-2-naphthalen-2-yloxyacetamide.
What is the SMILES notation for N-[3-(4-hydroxypiperidin-1-yl)propyl]-2-naphthalen-2-yloxyacetamide?
The canonical SMILES for N-[3-(4-hydroxypiperidin-1-yl)propyl]-2-naphthalen-2-yloxyacetamide is O=C(COc1ccc2ccccc2c1)NCCCN1CCC(O)CC1.
What is the InChIKey of N-[3-(4-hydroxypiperidin-1-yl)propyl]-2-naphthalen-2-yloxyacetamide?
The InChIKey is ZMEYGQGWFBDJRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O3/c23-18-8-12-22(13-9-18)11-3-10-21-20(24)15-25-19-7-6-16-4-1-2-5-17(16)14-19/h1-2,4-7,14,18,23H,3,8-13,15H2,(H,21,24).
What are the key properties of N-[3-(4-hydroxypiperidin-1-yl)propyl]-2-naphthalen-2-yloxyacetamide?
N-[3-(4-hydroxypiperidin-1-yl)propyl]-2-naphthalen-2-yloxyacetamide has a molecular weight of 342.44 g/mol, XLogP of 2.18, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(4-hydroxypiperidin-1-yl)propyl]-2-naphthalen-2-yloxyacetamide is sourced from PubChem (CID 111429697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).