2-(2-methoxyethoxy)-N-(3-piperidin-1-ylpropyl)acetamide

C13H26N2O3 — CID 113220096

IUPAC2-(2-methoxyethoxy)-N-(3-piperidin-1-ylpropyl)acetamide
SMILESCOCCOCC(=O)NCCCN1CCCCC1
InChIInChI=1S/C13H26N2O3/c1-17-10-11-18-12-13(16)14-6-5-9-15-7-3-2-4-8-15/h2-12H2,1H3,(H,14,16)
InChIKeyMCQRQLPMBDFDLH-UHFFFAOYSA-N
MW258.36 g/mol
LogP0.64
Rot. Bonds9

About 2-(2-methoxyethoxy)-N-(3-piperidin-1-ylpropyl)acetamide

2-(2-methoxyethoxy)-N-(3-piperidin-1-ylpropyl)acetamide (PubChem CID 113220096) has the molecular formula C13H26N2O3 and a molecular weight of 258.36 g/mol. Its IUPAC name is 2-(2-methoxyethoxy)-N-(3-piperidin-1-ylpropyl)acetamide.

Molecular Properties

Compound Name2-(2-methoxyethoxy)-N-(3-piperidin-1-ylpropyl)acetamide
PubChem CID113220096
Molecular FormulaC13H26N2O3
Molecular Weight258.36 g/mol
Exact Mass258.19
IUPAC Name2-(2-methoxyethoxy)-N-(3-piperidin-1-ylpropyl)acetamide
SMILESCOCCOCC(=O)NCCCN1CCCCC1
InChIInChI=1S/C13H26N2O3/c1-17-10-11-18-12-13(16)14-6-5-9-15-7-3-2-4-8-15/h2-12H2,1H3,(H,14,16)
InChIKeyMCQRQLPMBDFDLH-UHFFFAOYSA-N
XLogP0.64
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(2-methoxyethoxy)-N-(2-piperidin-1-ylethyl)acetamide
CID 113223173
2-(2-methoxyethoxy)-N-(3-morpholin-4-ylpropyl)acetamide
CID 103606858
2-(2-aminoethoxy)-N-(3-piperidin-1-ylpropyl)acetamide
CID 79464083
2-methoxy-N-(4-piperidin-1-ylbutyl)acetamide
CID 110443559
2-(2-methoxyethoxy)-N-(3-methoxypropyl)acetamide
CID 103601588
2-[2-[4-(2-aminooxyethyl)piperazin-1-yl]ethoxy]-N-[2-(2-methoxyethoxy)ethyl]acetamide
CID 177056741
N-[2-(2-methoxyethoxy)ethyl]-3-piperidin-1-ylpropan-1-amine
CID 114031951
2-(methylamino)-N-(3-piperidin-1-ylpropyl)acetamide
CID 43362949
methyl N-(4-piperidin-1-ylbutyl)carbamate
CID 97356284
2-(4-methoxyphenyl)-N-(3-piperidin-1-ylpropyl)acetamide
CID 92674422
2-[2-[2-(azepan-1-yl)ethylamino]-2-oxoethoxy]acetic acid
CID 53211349
ethane;1-(8-methoxyoctyl)piperidine
CID 142390794

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethoxy)-N-(3-piperidin-1-ylpropyl)acetamide?
The IUPAC name of 2-(2-methoxyethoxy)-N-(3-piperidin-1-ylpropyl)acetamide (CID 113220096) is 2-(2-methoxyethoxy)-N-(3-piperidin-1-ylpropyl)acetamide.
What is the SMILES notation for 2-(2-methoxyethoxy)-N-(3-piperidin-1-ylpropyl)acetamide?
The canonical SMILES for 2-(2-methoxyethoxy)-N-(3-piperidin-1-ylpropyl)acetamide is COCCOCC(=O)NCCCN1CCCCC1.
What is the InChIKey of 2-(2-methoxyethoxy)-N-(3-piperidin-1-ylpropyl)acetamide?
The InChIKey is MCQRQLPMBDFDLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O3/c1-17-10-11-18-12-13(16)14-6-5-9-15-7-3-2-4-8-15/h2-12H2,1H3,(H,14,16).
What are the key properties of 2-(2-methoxyethoxy)-N-(3-piperidin-1-ylpropyl)acetamide?
2-(2-methoxyethoxy)-N-(3-piperidin-1-ylpropyl)acetamide has a molecular weight of 258.36 g/mol, XLogP of 0.64, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethoxy)-N-(3-piperidin-1-ylpropyl)acetamide is sourced from PubChem (CID 113220096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).