2-[4-methoxybutyl(piperidin-4-yl)amino]acetamide

C12H25N3O2 — CID 104648571

IUPAC2-[4-methoxybutyl(piperidin-4-yl)amino]acetamide
SMILESCOCCCCN(CC(N)=O)C1CCNCC1
InChIInChI=1S/C12H25N3O2/c1-17-9-3-2-8-15(10-12(13)16)11-4-6-14-7-5-11/h11,14H,2-10H2,1H3,(H2,13,16)
InChIKeyFYKKYWKRVUFYLE-UHFFFAOYSA-N
MW243.35 g/mol
LogP-0.05
Rot. Bonds8

About 2-[4-methoxybutyl(piperidin-4-yl)amino]acetamide

2-[4-methoxybutyl(piperidin-4-yl)amino]acetamide (PubChem CID 104648571) has the molecular formula C12H25N3O2 and a molecular weight of 243.35 g/mol. Its IUPAC name is 2-[4-methoxybutyl(piperidin-4-yl)amino]acetamide.

Molecular Properties

Compound Name2-[4-methoxybutyl(piperidin-4-yl)amino]acetamide
PubChem CID104648571
Molecular FormulaC12H25N3O2
Molecular Weight243.35 g/mol
Exact Mass243.19
IUPAC Name2-[4-methoxybutyl(piperidin-4-yl)amino]acetamide
SMILESCOCCCCN(CC(N)=O)C1CCNCC1
InChIInChI=1S/C12H25N3O2/c1-17-9-3-2-8-15(10-12(13)16)11-4-6-14-7-5-11/h11,14H,2-10H2,1H3,(H2,13,16)
InChIKeyFYKKYWKRVUFYLE-UHFFFAOYSA-N
XLogP-0.05
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 5-0.05
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-(4-methoxybutyl)-N-propylpiperidin-4-amine
CID 115741630
2-[cyclopentyl(4-methoxybutyl)amino]-N'-hydroxyethanimidamide
CID 104647778
2-[2-cyclopentylethyl(piperidin-4-yl)amino]acetamide
CID 114191603
N,N-bis(2-methoxyethyl)piperidin-4-amine
CID 61418821
2-[3-(oxolan-2-yl)propyl-piperidin-4-ylamino]acetamide
CID 65162373
3-[(2-amino-2-oxoethyl)-piperidin-4-ylamino]-2-hydroxy-2-methylpropanoic acid
CID 104645042
ethyl N-(2-methoxyethyl)-N-piperidin-4-ylcarbamate
CID 156856713
2-[[2-[cyclopropyl(methyl)amino]-2-oxoethyl]-piperidin-4-ylamino]acetamide
CID 61489246
N-cyclopropyl-N-(2-methoxyethyl)piperidine-4-carboxamide
CID 60948031
2-[2-(3-methylphenoxy)ethyl-piperidin-4-ylamino]acetamide
CID 60802291
2-[piperidin-4-yl(prop-2-ynyl)amino]acetamide;dihydrochloride
CID 138040175
2-[2,3-dihydroxypropyl(piperidin-4-yl)amino]acetamide
CID 82849875

Frequently Asked Questions

What is the IUPAC name of 2-[4-methoxybutyl(piperidin-4-yl)amino]acetamide?
The IUPAC name of 2-[4-methoxybutyl(piperidin-4-yl)amino]acetamide (CID 104648571) is 2-[4-methoxybutyl(piperidin-4-yl)amino]acetamide.
What is the SMILES notation for 2-[4-methoxybutyl(piperidin-4-yl)amino]acetamide?
The canonical SMILES for 2-[4-methoxybutyl(piperidin-4-yl)amino]acetamide is COCCCCN(CC(N)=O)C1CCNCC1.
What is the InChIKey of 2-[4-methoxybutyl(piperidin-4-yl)amino]acetamide?
The InChIKey is FYKKYWKRVUFYLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O2/c1-17-9-3-2-8-15(10-12(13)16)11-4-6-14-7-5-11/h11,14H,2-10H2,1H3,(H2,13,16).
What are the key properties of 2-[4-methoxybutyl(piperidin-4-yl)amino]acetamide?
2-[4-methoxybutyl(piperidin-4-yl)amino]acetamide has a molecular weight of 243.35 g/mol, XLogP of -0.05, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-methoxybutyl(piperidin-4-yl)amino]acetamide is sourced from PubChem (CID 104648571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).