N-[2-(1-ethylpiperidin-4-yl)ethyl]-2-(2-methoxyethylamino)acetamide

C14H29N3O2 — CID 119885076

IUPACN-[2-(1-ethylpiperidin-4-yl)ethyl]-2-(2-methoxyethylamino)acetamide
SMILESCCN1CCC(CCNC(=O)CNCCOC)CC1
InChIInChI=1S/C14H29N3O2/c1-3-17-9-5-13(6-10-17)4-7-16-14(18)12-15-8-11-19-2/h13,15H,3-12H2,1-2H3,(H,16,18)
InChIKeyQMHKXOWUEIXWDS-UHFFFAOYSA-N
MW271.40 g/mol
LogP0.46
Rot. Bonds9

About N-[2-(1-ethylpiperidin-4-yl)ethyl]-2-(2-methoxyethylamino)acetamide

N-[2-(1-ethylpiperidin-4-yl)ethyl]-2-(2-methoxyethylamino)acetamide (PubChem CID 119885076) has the molecular formula C14H29N3O2 and a molecular weight of 271.40 g/mol. Its IUPAC name is N-[2-(1-ethylpiperidin-4-yl)ethyl]-2-(2-methoxyethylamino)acetamide.

Molecular Properties

Compound NameN-[2-(1-ethylpiperidin-4-yl)ethyl]-2-(2-methoxyethylamino)acetamide
PubChem CID119885076
Molecular FormulaC14H29N3O2
Molecular Weight271.40 g/mol
Exact Mass271.23
IUPAC NameN-[2-(1-ethylpiperidin-4-yl)ethyl]-2-(2-methoxyethylamino)acetamide
SMILESCCN1CCC(CCNC(=O)CNCCOC)CC1
InChIInChI=1S/C14H29N3O2/c1-3-17-9-5-13(6-10-17)4-7-16-14(18)12-15-8-11-19-2/h13,15H,3-12H2,1-2H3,(H,16,18)
InChIKeyQMHKXOWUEIXWDS-UHFFFAOYSA-N
XLogP0.46
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.40
LogP ≤ 50.46
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-(1-ethylpiperidin-4-yl)ethyl]-2-(2-methoxyethylamino)acetamide?
The IUPAC name of N-[2-(1-ethylpiperidin-4-yl)ethyl]-2-(2-methoxyethylamino)acetamide (CID 119885076) is N-[2-(1-ethylpiperidin-4-yl)ethyl]-2-(2-methoxyethylamino)acetamide.
What is the SMILES notation for N-[2-(1-ethylpiperidin-4-yl)ethyl]-2-(2-methoxyethylamino)acetamide?
The canonical SMILES for N-[2-(1-ethylpiperidin-4-yl)ethyl]-2-(2-methoxyethylamino)acetamide is CCN1CCC(CCNC(=O)CNCCOC)CC1.
What is the InChIKey of N-[2-(1-ethylpiperidin-4-yl)ethyl]-2-(2-methoxyethylamino)acetamide?
The InChIKey is QMHKXOWUEIXWDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O2/c1-3-17-9-5-13(6-10-17)4-7-16-14(18)12-15-8-11-19-2/h13,15H,3-12H2,1-2H3,(H,16,18).
What are the key properties of N-[2-(1-ethylpiperidin-4-yl)ethyl]-2-(2-methoxyethylamino)acetamide?
N-[2-(1-ethylpiperidin-4-yl)ethyl]-2-(2-methoxyethylamino)acetamide has a molecular weight of 271.40 g/mol, XLogP of 0.46, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-ethylpiperidin-4-yl)ethyl]-2-(2-methoxyethylamino)acetamide is sourced from PubChem (CID 119885076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).