N-[2-(2-methoxyethoxy)ethyl]-2-(2-oxopiperidin-1-yl)acetamide

C12H22N2O4 — CID 78874251

IUPACN-[2-(2-methoxyethoxy)ethyl]-2-(2-oxopiperidin-1-yl)acetamide
SMILESCOCCOCCNC(=O)CN1CCCCC1=O
InChIInChI=1S/C12H22N2O4/c1-17-8-9-18-7-5-13-11(15)10-14-6-3-2-4-12(14)16/h2-10H2,1H3,(H,13,15)
InChIKeyWWYVATRDHVZCPT-UHFFFAOYSA-N
MW258.32 g/mol
LogP-0.22
Rot. Bonds8

About N-[2-(2-methoxyethoxy)ethyl]-2-(2-oxopiperidin-1-yl)acetamide

N-[2-(2-methoxyethoxy)ethyl]-2-(2-oxopiperidin-1-yl)acetamide (PubChem CID 78874251) has the molecular formula C12H22N2O4 and a molecular weight of 258.32 g/mol. Its IUPAC name is N-[2-(2-methoxyethoxy)ethyl]-2-(2-oxopiperidin-1-yl)acetamide.

Molecular Properties

Compound NameN-[2-(2-methoxyethoxy)ethyl]-2-(2-oxopiperidin-1-yl)acetamide
PubChem CID78874251
Molecular FormulaC12H22N2O4
Molecular Weight258.32 g/mol
Exact Mass258.16
IUPAC NameN-[2-(2-methoxyethoxy)ethyl]-2-(2-oxopiperidin-1-yl)acetamide
SMILESCOCCOCCNC(=O)CN1CCCCC1=O
InChIInChI=1S/C12H22N2O4/c1-17-8-9-18-7-5-13-11(15)10-14-6-3-2-4-12(14)16/h2-10H2,1H3,(H,13,15)
InChIKeyWWYVATRDHVZCPT-UHFFFAOYSA-N
XLogP-0.22
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 5-0.22
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

N-(3-methoxypropyl)-2-(2-oxopyrrolidin-1-yl)acetamide
CID 94869868
N-[2-(2-methylprop-2-enoxy)ethyl]-2-(2-oxopyrrolidin-1-yl)acetamide
CID 115700259
N-(2-hydroxyethyl)-2-(2-oxoazepan-1-yl)acetamide
CID 43388932
N-(3-hydroxy-4-methoxybutyl)-2-(2-oxopyrrolidin-1-yl)acetamide
CID 103876710
N-(2-hydroxy-4-methoxy-2-methylbutyl)-2-(2-oxoazepan-1-yl)acetamide
CID 103712564
2-(2-oxopiperidin-1-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]acetamide
CID 86984731
2-[[2-(2-oxopyrrolidin-1-yl)acetyl]amino]-N-propylacetamide
CID 56810104
2-[2-[[2-(2-oxoazocan-1-yl)acetyl]amino]ethylsulfanyl]acetic acid
CID 119241925
2-[[2-(2-oxoazocan-1-yl)acetyl]amino]acetic acid
CID 119171385
N-[2-(dimethylamino)ethyl]-2-(2-oxopyrrolidin-1-yl)acetamide;hydrochloride
CID 21327798
1-(3-methoxy-2-oxopropyl)piperidin-2-one
CID 107507681
2-(2-oxopiperidin-1-yl)-N-propan-2-ylacetamide
CID 110689762

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methoxyethoxy)ethyl]-2-(2-oxopiperidin-1-yl)acetamide?
The IUPAC name of N-[2-(2-methoxyethoxy)ethyl]-2-(2-oxopiperidin-1-yl)acetamide (CID 78874251) is N-[2-(2-methoxyethoxy)ethyl]-2-(2-oxopiperidin-1-yl)acetamide.
What is the SMILES notation for N-[2-(2-methoxyethoxy)ethyl]-2-(2-oxopiperidin-1-yl)acetamide?
The canonical SMILES for N-[2-(2-methoxyethoxy)ethyl]-2-(2-oxopiperidin-1-yl)acetamide is COCCOCCNC(=O)CN1CCCCC1=O.
What is the InChIKey of N-[2-(2-methoxyethoxy)ethyl]-2-(2-oxopiperidin-1-yl)acetamide?
The InChIKey is WWYVATRDHVZCPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O4/c1-17-8-9-18-7-5-13-11(15)10-14-6-3-2-4-12(14)16/h2-10H2,1H3,(H,13,15).
What are the key properties of N-[2-(2-methoxyethoxy)ethyl]-2-(2-oxopiperidin-1-yl)acetamide?
N-[2-(2-methoxyethoxy)ethyl]-2-(2-oxopiperidin-1-yl)acetamide has a molecular weight of 258.32 g/mol, XLogP of -0.22, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methoxyethoxy)ethyl]-2-(2-oxopiperidin-1-yl)acetamide is sourced from PubChem (CID 78874251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).