N-[2-(2-tert-butylphenoxy)ethyl]-2-(2-methoxyethylamino)acetamide;hydrochloride

C17H29ClN2O3 — CID 119780509

IUPACN-[2-(2-tert-butylphenoxy)ethyl]-2-(2-methoxyethylamino)acetamide;hydrochloride
SMILESCOCCNCC(=O)NCCOc1ccccc1C(C)(C)C.Cl
InChIInChI=1S/C17H28N2O3.ClH/c1-17(2,3)14-7-5-6-8-15(14)22-12-10-19-16(20)13-18-9-11-21-4;/h5-8,18H,9-13H2,1-4H3,(H,19,20);1H
InChIKeyUZZMLRNTHHUCHN-UHFFFAOYSA-N
MW344.88 g/mol
LogP2.14
Rot. Bonds9

About N-[2-(2-tert-butylphenoxy)ethyl]-2-(2-methoxyethylamino)acetamide;hydrochloride

N-[2-(2-tert-butylphenoxy)ethyl]-2-(2-methoxyethylamino)acetamide;hydrochloride (PubChem CID 119780509) has the molecular formula C17H29ClN2O3 and a molecular weight of 344.88 g/mol. Its IUPAC name is N-[2-(2-tert-butylphenoxy)ethyl]-2-(2-methoxyethylamino)acetamide;hydrochloride.

Molecular Properties

Compound NameN-[2-(2-tert-butylphenoxy)ethyl]-2-(2-methoxyethylamino)acetamide;hydrochloride
PubChem CID119780509
Molecular FormulaC17H29ClN2O3
Molecular Weight344.88 g/mol
Exact Mass344.19
IUPAC NameN-[2-(2-tert-butylphenoxy)ethyl]-2-(2-methoxyethylamino)acetamide;hydrochloride
SMILESCOCCNCC(=O)NCCOc1ccccc1C(C)(C)C.Cl
InChIInChI=1S/C17H28N2O3.ClH/c1-17(2,3)14-7-5-6-8-15(14)22-12-10-19-16(20)13-18-9-11-21-4;/h5-8,18H,9-13H2,1-4H3,(H,19,20);1H
InChIKeyUZZMLRNTHHUCHN-UHFFFAOYSA-N
XLogP2.14
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.88
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[2-(2-tert-butylphenoxy)ethyl]-2-(2-methoxyethylamino)acetamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2-methoxyethylamino)-N-(2-naphthalen-1-yloxyethyl)acetamide;hydrochloride
CID 119738774
3-amino-N-[2-(2-tert-butylphenoxy)ethyl]propanamide;hydrochloride
CID 119321799
2-amino-N-[2-(2-tert-butylphenoxy)ethyl]-3-methoxypropanamide
CID 120989442
2-(2-tert-butylphenoxy)ethylcarbamic acid
CID 118869764
N-[2-(2-chlorophenyl)-2-methylpropyl]-2-(2-methoxyethylamino)acetamide;hydrochloride
CID 119773052
2-[2-(2-tert-butylphenoxy)ethylamino]ethanol
CID 39259210
2-(2-tert-butylphenoxy)-N-ethylethanamine
CID 29015338
2-(2-methoxyethylamino)-N-[[2-(trifluoromethyl)phenyl]methyl]acetamide
CID 79282836
3-amino-N-[2-(2-tert-butylphenoxy)ethyl]benzamide;hydrochloride
CID 119780497
N-[2-(2-tert-butylphenoxy)ethyl]-2-pyrrolidin-2-ylacetamide
CID 119780508
N-ethyl-2-[2-(2-methoxyphenoxy)ethylamino]acetamide
CID 60672629
1-tert-butyl-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]benzene
CID 104567723

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-tert-butylphenoxy)ethyl]-2-(2-methoxyethylamino)acetamide;hydrochloride?
The IUPAC name of N-[2-(2-tert-butylphenoxy)ethyl]-2-(2-methoxyethylamino)acetamide;hydrochloride (CID 119780509) is N-[2-(2-tert-butylphenoxy)ethyl]-2-(2-methoxyethylamino)acetamide;hydrochloride.
What is the SMILES notation for N-[2-(2-tert-butylphenoxy)ethyl]-2-(2-methoxyethylamino)acetamide;hydrochloride?
The canonical SMILES for N-[2-(2-tert-butylphenoxy)ethyl]-2-(2-methoxyethylamino)acetamide;hydrochloride is COCCNCC(=O)NCCOc1ccccc1C(C)(C)C.Cl.
What is the InChIKey of N-[2-(2-tert-butylphenoxy)ethyl]-2-(2-methoxyethylamino)acetamide;hydrochloride?
The InChIKey is UZZMLRNTHHUCHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O3.ClH/c1-17(2,3)14-7-5-6-8-15(14)22-12-10-19-16(20)13-18-9-11-21-4;/h5-8,18H,9-13H2,1-4H3,(H,19,20);1H.
What are the key properties of N-[2-(2-tert-butylphenoxy)ethyl]-2-(2-methoxyethylamino)acetamide;hydrochloride?
N-[2-(2-tert-butylphenoxy)ethyl]-2-(2-methoxyethylamino)acetamide;hydrochloride has a molecular weight of 344.88 g/mol, XLogP of 2.14, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-tert-butylphenoxy)ethyl]-2-(2-methoxyethylamino)acetamide;hydrochloride is sourced from PubChem (CID 119780509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).