N-[2-(2-aminoethoxy)ethyl]-2-(4-ethoxyphenyl)acetamide

C14H22N2O3 — CID 82354234

IUPACN-[2-(2-aminoethoxy)ethyl]-2-(4-ethoxyphenyl)acetamide
SMILESCCOc1ccc(CC(=O)NCCOCCN)cc1
InChIInChI=1S/C14H22N2O3/c1-2-19-13-5-3-12(4-6-13)11-14(17)16-8-10-18-9-7-15/h3-6H,2,7-11,15H2,1H3,(H,16,17)
InChIKeyKZJNAUNWZKZJBS-UHFFFAOYSA-N
MW266.34 g/mol
LogP0.72
Rot. Bonds9

About N-[2-(2-aminoethoxy)ethyl]-2-(4-ethoxyphenyl)acetamide

N-[2-(2-aminoethoxy)ethyl]-2-(4-ethoxyphenyl)acetamide (PubChem CID 82354234) has the molecular formula C14H22N2O3 and a molecular weight of 266.34 g/mol. Its IUPAC name is N-[2-(2-aminoethoxy)ethyl]-2-(4-ethoxyphenyl)acetamide.

Molecular Properties

Compound NameN-[2-(2-aminoethoxy)ethyl]-2-(4-ethoxyphenyl)acetamide
PubChem CID82354234
Molecular FormulaC14H22N2O3
Molecular Weight266.34 g/mol
Exact Mass266.16
IUPAC NameN-[2-(2-aminoethoxy)ethyl]-2-(4-ethoxyphenyl)acetamide
SMILESCCOc1ccc(CC(=O)NCCOCCN)cc1
InChIInChI=1S/C14H22N2O3/c1-2-19-13-5-3-12(4-6-13)11-14(17)16-8-10-18-9-7-15/h3-6H,2,7-11,15H2,1H3,(H,16,17)
InChIKeyKZJNAUNWZKZJBS-UHFFFAOYSA-N
XLogP0.72
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 50.72
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

ethyl N-[2-[[2-(4-ethoxyphenyl)acetyl]amino]ethyl]carbamate
CID 108573122
N-[2-[[2-(4-ethoxyphenyl)acetyl]amino]ethyl]butanamide
CID 108573115
N-[2-(dimethylamino)ethyl]-2-(4-ethoxyphenyl)acetamide
CID 110757113
N-[2-(2-aminoethoxy)ethyl]-4-butoxybenzamide
CID 63755737
N-but-3-enyl-2-(4-ethoxyphenyl)acetamide
CID 113466030
N-[2-(3-bromophenoxy)ethyl]-2-(4-ethoxyphenyl)acetamide
CID 55920744
N-[2-(4-methylphenoxy)ethyl]-2-(4-methylphenyl)acetamide
CID 40724453
N-[2-[2-[[2-(4-ethoxyphenyl)acetyl]amino]ethylamino]-2-oxoethyl]benzamide
CID 108539279
N-(2-aminoethyl)-4-(4-ethoxyphenoxy)butanamide
CID 119382448
2-cyano-N-[3-[[2-(4-ethoxyphenyl)acetyl]amino]propyl]acetamide
CID 108924311
N-[2-(2-aminoethoxy)ethyl]-2-(2,5-dimethylphenyl)acetamide
CID 63756094
N-[2-(4-ethoxyphenoxy)ethyl]-2-(3-methylphenyl)acetamide
CID 30350207

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-aminoethoxy)ethyl]-2-(4-ethoxyphenyl)acetamide?
The IUPAC name of N-[2-(2-aminoethoxy)ethyl]-2-(4-ethoxyphenyl)acetamide (CID 82354234) is N-[2-(2-aminoethoxy)ethyl]-2-(4-ethoxyphenyl)acetamide.
What is the SMILES notation for N-[2-(2-aminoethoxy)ethyl]-2-(4-ethoxyphenyl)acetamide?
The canonical SMILES for N-[2-(2-aminoethoxy)ethyl]-2-(4-ethoxyphenyl)acetamide is CCOc1ccc(CC(=O)NCCOCCN)cc1.
What is the InChIKey of N-[2-(2-aminoethoxy)ethyl]-2-(4-ethoxyphenyl)acetamide?
The InChIKey is KZJNAUNWZKZJBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3/c1-2-19-13-5-3-12(4-6-13)11-14(17)16-8-10-18-9-7-15/h3-6H,2,7-11,15H2,1H3,(H,16,17).
What are the key properties of N-[2-(2-aminoethoxy)ethyl]-2-(4-ethoxyphenyl)acetamide?
N-[2-(2-aminoethoxy)ethyl]-2-(4-ethoxyphenyl)acetamide has a molecular weight of 266.34 g/mol, XLogP of 0.72, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-aminoethoxy)ethyl]-2-(4-ethoxyphenyl)acetamide is sourced from PubChem (CID 82354234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).