N-(2-methoxyethyl)-2-[methyl(2-piperidin-2-ylethyl)amino]acetamide

C13H27N3O2 — CID 54989176

IUPACN-(2-methoxyethyl)-2-[methyl(2-piperidin-2-ylethyl)amino]acetamide
SMILESCOCCNC(=O)CN(C)CCC1CCCCN1
InChIInChI=1S/C13H27N3O2/c1-16(11-13(17)15-8-10-18-2)9-6-12-5-3-4-7-14-12/h12,14H,3-11H2,1-2H3,(H,15,17)
InChIKeyISXKDAIJWXFSQB-UHFFFAOYSA-N
MW257.38 g/mol
LogP0.21
Rot. Bonds8

About N-(2-methoxyethyl)-2-[methyl(2-piperidin-2-ylethyl)amino]acetamide

N-(2-methoxyethyl)-2-[methyl(2-piperidin-2-ylethyl)amino]acetamide (PubChem CID 54989176) has the molecular formula C13H27N3O2 and a molecular weight of 257.38 g/mol. Its IUPAC name is N-(2-methoxyethyl)-2-[methyl(2-piperidin-2-ylethyl)amino]acetamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-2-[methyl(2-piperidin-2-ylethyl)amino]acetamide
PubChem CID54989176
Molecular FormulaC13H27N3O2
Molecular Weight257.38 g/mol
Exact Mass257.21
IUPAC NameN-(2-methoxyethyl)-2-[methyl(2-piperidin-2-ylethyl)amino]acetamide
SMILESCOCCNC(=O)CN(C)CCC1CCCCN1
InChIInChI=1S/C13H27N3O2/c1-16(11-13(17)15-8-10-18-2)9-6-12-5-3-4-7-14-12/h12,14H,3-11H2,1-2H3,(H,15,17)
InChIKeyISXKDAIJWXFSQB-UHFFFAOYSA-N
XLogP0.21
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.38
LogP ≤ 50.21
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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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-2-[methyl(2-piperidin-2-ylethyl)amino]acetamide?
The IUPAC name of N-(2-methoxyethyl)-2-[methyl(2-piperidin-2-ylethyl)amino]acetamide (CID 54989176) is N-(2-methoxyethyl)-2-[methyl(2-piperidin-2-ylethyl)amino]acetamide.
What is the SMILES notation for N-(2-methoxyethyl)-2-[methyl(2-piperidin-2-ylethyl)amino]acetamide?
The canonical SMILES for N-(2-methoxyethyl)-2-[methyl(2-piperidin-2-ylethyl)amino]acetamide is COCCNC(=O)CN(C)CCC1CCCCN1.
What is the InChIKey of N-(2-methoxyethyl)-2-[methyl(2-piperidin-2-ylethyl)amino]acetamide?
The InChIKey is ISXKDAIJWXFSQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O2/c1-16(11-13(17)15-8-10-18-2)9-6-12-5-3-4-7-14-12/h12,14H,3-11H2,1-2H3,(H,15,17).
What are the key properties of N-(2-methoxyethyl)-2-[methyl(2-piperidin-2-ylethyl)amino]acetamide?
N-(2-methoxyethyl)-2-[methyl(2-piperidin-2-ylethyl)amino]acetamide has a molecular weight of 257.38 g/mol, XLogP of 0.21, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-2-[methyl(2-piperidin-2-ylethyl)amino]acetamide is sourced from PubChem (CID 54989176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).