2-methoxy-N-(4-piperidin-1-ylbutyl)acetamide

C12H24N2O2 — CID 110443559

IUPAC2-methoxy-N-(4-piperidin-1-ylbutyl)acetamide
SMILESCOCC(=O)NCCCCN1CCCCC1
InChIInChI=1S/C12H24N2O2/c1-16-11-12(15)13-7-3-6-10-14-8-4-2-5-9-14/h2-11H2,1H3,(H,13,15)
InChIKeyOTKJXEMKSZVYAL-UHFFFAOYSA-N
MW228.34 g/mol
LogP1.02
Rot. Bonds7

About 2-methoxy-N-(4-piperidin-1-ylbutyl)acetamide

2-methoxy-N-(4-piperidin-1-ylbutyl)acetamide (PubChem CID 110443559) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 2-methoxy-N-(4-piperidin-1-ylbutyl)acetamide.

Molecular Properties

Compound Name2-methoxy-N-(4-piperidin-1-ylbutyl)acetamide
PubChem CID110443559
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name2-methoxy-N-(4-piperidin-1-ylbutyl)acetamide
SMILESCOCC(=O)NCCCCN1CCCCC1
InChIInChI=1S/C12H24N2O2/c1-16-11-12(15)13-7-3-6-10-14-8-4-2-5-9-14/h2-11H2,1H3,(H,13,15)
InChIKeyOTKJXEMKSZVYAL-UHFFFAOYSA-N
XLogP1.02
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(2-methoxyethoxy)-N-(3-piperidin-1-ylpropyl)acetamide
CID 113220096
methyl N-(4-piperidin-1-ylbutyl)carbamate
CID 97356284
2-(2-methoxyethoxy)-N-(2-piperidin-1-ylethyl)acetamide
CID 113223173
2-(methylamino)-N-(3-piperidin-1-ylpropyl)acetamide
CID 43362949
N-[5-(azepan-1-yl)pentyl]acetamide
CID 110441166
2-(2-aminoethoxy)-N-(3-piperidin-1-ylpropyl)acetamide
CID 79464083
5-oxo-5-(3-piperidin-1-ylpropylamino)pentanoic acid
CID 43579827
2-methoxy-N-(3-oxo-3-piperidin-1-ylpropyl)acetamide
CID 115581606
N-[5-(azepan-1-yl)pentyl]-2-methylpropanamide
CID 110441883
N-(3-pyrrolidin-1-ylpropyl)butanamide
CID 60668593
N-[2-(azepan-1-yl)ethyl]-2-propan-2-yloxyacetamide
CID 112686819
2-methoxy-N-(2-piperazin-1-ylethyl)acetamide;hydrochloride
CID 119446588

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-(4-piperidin-1-ylbutyl)acetamide?
The IUPAC name of 2-methoxy-N-(4-piperidin-1-ylbutyl)acetamide (CID 110443559) is 2-methoxy-N-(4-piperidin-1-ylbutyl)acetamide.
What is the SMILES notation for 2-methoxy-N-(4-piperidin-1-ylbutyl)acetamide?
The canonical SMILES for 2-methoxy-N-(4-piperidin-1-ylbutyl)acetamide is COCC(=O)NCCCCN1CCCCC1.
What is the InChIKey of 2-methoxy-N-(4-piperidin-1-ylbutyl)acetamide?
The InChIKey is OTKJXEMKSZVYAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-16-11-12(15)13-7-3-6-10-14-8-4-2-5-9-14/h2-11H2,1H3,(H,13,15).
What are the key properties of 2-methoxy-N-(4-piperidin-1-ylbutyl)acetamide?
2-methoxy-N-(4-piperidin-1-ylbutyl)acetamide has a molecular weight of 228.34 g/mol, XLogP of 1.02, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(4-piperidin-1-ylbutyl)acetamide is sourced from PubChem (CID 110443559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).