ethane;N-[2-[2-[2-[2-[2-(1-methylpiperidin-4-yl)oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]acetamide

C20H42N2O6 — CID 171081964

IUPACethane;N-[2-[2-[2-[2-[2-(1-methylpiperidin-4-yl)oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]acetamide
SMILESCC.CC(=O)NCCOCCOCCOCCOCCOC1CCN(C)CC1
InChIInChI=1S/C18H36N2O6.C2H6/c1-17(21)19-5-8-22-9-10-23-11-12-24-13-14-25-15-16-26-18-3-6-20(2)7-4-18;1-2/h18H,3-16H2,1-2H3,(H,19,21);1-2H3
InChIKeyWEYHXUFJCSHPHC-UHFFFAOYSA-N
MW406.56 g/mol
LogP1.33
Rot. Bonds16

About ethane;N-[2-[2-[2-[2-[2-(1-methylpiperidin-4-yl)oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]acetamide

ethane;N-[2-[2-[2-[2-[2-(1-methylpiperidin-4-yl)oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]acetamide (PubChem CID 171081964) has the molecular formula C20H42N2O6 and a molecular weight of 406.56 g/mol. Its IUPAC name is ethane;N-[2-[2-[2-[2-[2-(1-methylpiperidin-4-yl)oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]acetamide.

Molecular Properties

Compound Nameethane;N-[2-[2-[2-[2-[2-(1-methylpiperidin-4-yl)oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]acetamide
PubChem CID171081964
Molecular FormulaC20H42N2O6
Molecular Weight406.56 g/mol
Exact Mass406.30
IUPAC Nameethane;N-[2-[2-[2-[2-[2-(1-methylpiperidin-4-yl)oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]acetamide
SMILESCC.CC(=O)NCCOCCOCCOCCOCCOC1CCN(C)CC1
InChIInChI=1S/C18H36N2O6.C2H6/c1-17(21)19-5-8-22-9-10-23-11-12-24-13-14-25-15-16-26-18-3-6-20(2)7-4-18;1-2/h18H,3-16H2,1-2H3,(H,19,21);1-2H3
InChIKeyWEYHXUFJCSHPHC-UHFFFAOYSA-N
XLogP1.33
TPSA78.49 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds16
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.56
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

N-[2-[2-[2-[2-(4-methylpiperazin-1-yl)ethoxy]ethoxy]ethoxy]ethyl]acetamide
CID 164557571
N-[2-[2-(2-acetamidoethoxy)ethoxy]ethyl]acetamide
CID 18674787
ethane;1-methyl-N-[2-[2-(methylamino)ethoxy]ethyl]piperidine-4-carboxamide
CID 177054985
ethane;N-[2-(1-methylpiperidin-4-yl)ethyl]acetamide
CID 145305078
N-[2-(2-butoxyethoxy)ethyl]acetamide;ethane
CID 163393772
1-amino-3-[2-[2-[2-(1-propan-2-ylpiperidin-4-yl)oxyethoxy]ethoxy]ethyl]urea
CID 171081625
2-[4-[2-[2-[2-(2-methoxyethoxy)ethylamino]-2-oxoethoxy]ethoxy]piperidin-1-yl]-N-methylacetamide
CID 177054730
2-[1-[2-(2-methoxyethoxy)ethylcarbamoyl]piperidin-4-yl]oxyacetic acid
CID 63876279
4-[4-(1-methylpiperidin-4-yl)oxybutoxy]butan-1-ol
CID 175636399
N-[2-[2-(4-methylpentoxy)ethoxy]ethyl]acetamide
CID 153390509
N-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethyl]acetamide
CID 87190698
2-(dimethylcarbamoylamino)-N-[3-(1-methylpiperidin-4-yl)oxypropyl]acetamide
CID 122564451

Frequently Asked Questions

What is the IUPAC name of ethane;N-[2-[2-[2-[2-[2-(1-methylpiperidin-4-yl)oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]acetamide?
The IUPAC name of ethane;N-[2-[2-[2-[2-[2-(1-methylpiperidin-4-yl)oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]acetamide (CID 171081964) is ethane;N-[2-[2-[2-[2-[2-(1-methylpiperidin-4-yl)oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]acetamide.
What is the SMILES notation for ethane;N-[2-[2-[2-[2-[2-(1-methylpiperidin-4-yl)oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]acetamide?
The canonical SMILES for ethane;N-[2-[2-[2-[2-[2-(1-methylpiperidin-4-yl)oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]acetamide is CC.CC(=O)NCCOCCOCCOCCOCCOC1CCN(C)CC1.
What is the InChIKey of ethane;N-[2-[2-[2-[2-[2-(1-methylpiperidin-4-yl)oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]acetamide?
The InChIKey is WEYHXUFJCSHPHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36N2O6.C2H6/c1-17(21)19-5-8-22-9-10-23-11-12-24-13-14-25-15-16-26-18-3-6-20(2)7-4-18;1-2/h18H,3-16H2,1-2H3,(H,19,21);1-2H3.
What are the key properties of ethane;N-[2-[2-[2-[2-[2-(1-methylpiperidin-4-yl)oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]acetamide?
ethane;N-[2-[2-[2-[2-[2-(1-methylpiperidin-4-yl)oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]acetamide has a molecular weight of 406.56 g/mol, XLogP of 1.33, 16 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-[2-[2-[2-[2-[2-(1-methylpiperidin-4-yl)oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl]acetamide is sourced from PubChem (CID 171081964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).