2-(2-methoxyethylamino)-N-(2-propan-2-yloxyphenyl)acetamide;hydrochloride

C14H23ClN2O3 — CID 119714872

IUPAC2-(2-methoxyethylamino)-N-(2-propan-2-yloxyphenyl)acetamide;hydrochloride
SMILESCOCCNCC(=O)Nc1ccccc1OC(C)C.Cl
InChIInChI=1S/C14H22N2O3.ClH/c1-11(2)19-13-7-5-4-6-12(13)16-14(17)10-15-8-9-18-3;/h4-7,11,15H,8-10H2,1-3H3,(H,16,17);1H
InChIKeyAGEHRWCNLMVHNB-UHFFFAOYSA-N
MW302.80 g/mol
LogP2.07
Rot. Bonds8

About 2-(2-methoxyethylamino)-N-(2-propan-2-yloxyphenyl)acetamide;hydrochloride

2-(2-methoxyethylamino)-N-(2-propan-2-yloxyphenyl)acetamide;hydrochloride (PubChem CID 119714872) has the molecular formula C14H23ClN2O3 and a molecular weight of 302.80 g/mol. Its IUPAC name is 2-(2-methoxyethylamino)-N-(2-propan-2-yloxyphenyl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-(2-methoxyethylamino)-N-(2-propan-2-yloxyphenyl)acetamide;hydrochloride
PubChem CID119714872
Molecular FormulaC14H23ClN2O3
Molecular Weight302.80 g/mol
Exact Mass302.14
IUPAC Name2-(2-methoxyethylamino)-N-(2-propan-2-yloxyphenyl)acetamide;hydrochloride
SMILESCOCCNCC(=O)Nc1ccccc1OC(C)C.Cl
InChIInChI=1S/C14H22N2O3.ClH/c1-11(2)19-13-7-5-4-6-12(13)16-14(17)10-15-8-9-18-3;/h4-7,11,15H,8-10H2,1-3H3,(H,16,17);1H
InChIKeyAGEHRWCNLMVHNB-UHFFFAOYSA-N
XLogP2.07
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.80
LogP ≤ 52.07
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 2-(2-methoxyethylamino)-N-(2-propan-2-yloxyphenyl)acetamide;hydrochloride?
The IUPAC name of 2-(2-methoxyethylamino)-N-(2-propan-2-yloxyphenyl)acetamide;hydrochloride (CID 119714872) is 2-(2-methoxyethylamino)-N-(2-propan-2-yloxyphenyl)acetamide;hydrochloride.
What is the SMILES notation for 2-(2-methoxyethylamino)-N-(2-propan-2-yloxyphenyl)acetamide;hydrochloride?
The canonical SMILES for 2-(2-methoxyethylamino)-N-(2-propan-2-yloxyphenyl)acetamide;hydrochloride is COCCNCC(=O)Nc1ccccc1OC(C)C.Cl.
What is the InChIKey of 2-(2-methoxyethylamino)-N-(2-propan-2-yloxyphenyl)acetamide;hydrochloride?
The InChIKey is AGEHRWCNLMVHNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3.ClH/c1-11(2)19-13-7-5-4-6-12(13)16-14(17)10-15-8-9-18-3;/h4-7,11,15H,8-10H2,1-3H3,(H,16,17);1H.
What are the key properties of 2-(2-methoxyethylamino)-N-(2-propan-2-yloxyphenyl)acetamide;hydrochloride?
2-(2-methoxyethylamino)-N-(2-propan-2-yloxyphenyl)acetamide;hydrochloride has a molecular weight of 302.80 g/mol, XLogP of 2.07, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethylamino)-N-(2-propan-2-yloxyphenyl)acetamide;hydrochloride is sourced from PubChem (CID 119714872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).