N-(4-aminophenyl)-2-(2-methoxyethoxy)acetamide;hydrochloride

C11H17ClN2O3 — CID 91844892

IUPACN-(4-aminophenyl)-2-(2-methoxyethoxy)acetamide;hydrochloride
SMILESCOCCOCC(=O)Nc1ccc(N)cc1.Cl
InChIInChI=1S/C11H16N2O3.ClH/c1-15-6-7-16-8-11(14)13-10-4-2-9(12)3-5-10;/h2-5H,6-8,12H2,1H3,(H,13,14);1H
InChIKeyXLLYSFCRHRKAHV-UHFFFAOYSA-N
MW260.72 g/mol
LogP1.29
Rot. Bonds6

About N-(4-aminophenyl)-2-(2-methoxyethoxy)acetamide;hydrochloride

N-(4-aminophenyl)-2-(2-methoxyethoxy)acetamide;hydrochloride (PubChem CID 91844892) has the molecular formula C11H17ClN2O3 and a molecular weight of 260.72 g/mol. Its IUPAC name is N-(4-aminophenyl)-2-(2-methoxyethoxy)acetamide;hydrochloride.

Molecular Properties

Compound NameN-(4-aminophenyl)-2-(2-methoxyethoxy)acetamide;hydrochloride
PubChem CID91844892
Molecular FormulaC11H17ClN2O3
Molecular Weight260.72 g/mol
Exact Mass260.09
IUPAC NameN-(4-aminophenyl)-2-(2-methoxyethoxy)acetamide;hydrochloride
SMILESCOCCOCC(=O)Nc1ccc(N)cc1.Cl
InChIInChI=1S/C11H16N2O3.ClH/c1-15-6-7-16-8-11(14)13-10-4-2-9(12)3-5-10;/h2-5H,6-8,12H2,1H3,(H,13,14);1H
InChIKeyXLLYSFCRHRKAHV-UHFFFAOYSA-N
XLogP1.29
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.72
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_no_alk(40)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-[4-(1-aminoethyl)phenyl]-2-(2-methoxyethoxy)acetamide;hydrochloride
CID 119625634
2-(2-methoxyethoxy)-N-(4-propylphenyl)acetamide
CID 103606707
N-(4-aminophenyl)-2-(4,4,4-trifluorobutoxy)acetamide
CID 82789395
2-(2-methoxyethoxy)-N-[4-(2,2,2-trifluoroethoxy)phenyl]acetamide
CID 103606770
N-(4-carbamothioylphenyl)-2-(3-methoxypropoxy)acetamide
CID 54936159
N-(4-acetamidophenyl)-2-(2-aminoethoxy)acetamide
CID 79463401
N-(3-hydroxy-4-methoxyphenyl)-2-(2-methoxyethoxy)acetamide
CID 114032049
N-(6-bromo-3-pyridinyl)-2-(2-methoxyethoxy)acetamide
CID 103789411
2-[2-[2-(4-ethoxyanilino)-2-oxoethoxy]ethoxy]-N-(4-ethoxyphenyl)acetamide
CID 101189832
2-ethoxy-N-[4-(2-methoxyethoxy)phenyl]acetamide
CID 60758701
N-(4-aminophenyl)-4-[ethyl(2-methoxyethyl)amino]butanamide
CID 61444637
N-(4-aminophenyl)-2-(3-methoxypropylsulfinyl)acetamide
CID 63855766

Frequently Asked Questions

What is the IUPAC name of N-(4-aminophenyl)-2-(2-methoxyethoxy)acetamide;hydrochloride?
The IUPAC name of N-(4-aminophenyl)-2-(2-methoxyethoxy)acetamide;hydrochloride (CID 91844892) is N-(4-aminophenyl)-2-(2-methoxyethoxy)acetamide;hydrochloride.
What is the SMILES notation for N-(4-aminophenyl)-2-(2-methoxyethoxy)acetamide;hydrochloride?
The canonical SMILES for N-(4-aminophenyl)-2-(2-methoxyethoxy)acetamide;hydrochloride is COCCOCC(=O)Nc1ccc(N)cc1.Cl.
What is the InChIKey of N-(4-aminophenyl)-2-(2-methoxyethoxy)acetamide;hydrochloride?
The InChIKey is XLLYSFCRHRKAHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O3.ClH/c1-15-6-7-16-8-11(14)13-10-4-2-9(12)3-5-10;/h2-5H,6-8,12H2,1H3,(H,13,14);1H.
What are the key properties of N-(4-aminophenyl)-2-(2-methoxyethoxy)acetamide;hydrochloride?
N-(4-aminophenyl)-2-(2-methoxyethoxy)acetamide;hydrochloride has a molecular weight of 260.72 g/mol, XLogP of 1.29, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminophenyl)-2-(2-methoxyethoxy)acetamide;hydrochloride is sourced from PubChem (CID 91844892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).