N-(2-ethylphenyl)-2-(2-methoxyethylamino)propanamide;hydrochloride

C14H23ClN2O2 — CID 3025329

IUPACN-(2-ethylphenyl)-2-(2-methoxyethylamino)propanamide;hydrochloride
SMILESCCc1ccccc1NC(=O)C(C)NCCOC.Cl
InChIInChI=1S/C14H22N2O2.ClH/c1-4-12-7-5-6-8-13(12)16-14(17)11(2)15-9-10-18-3;/h5-8,11,15H,4,9-10H2,1-3H3,(H,16,17);1H
InChIKeyAJVCSZSYJRGGIP-UHFFFAOYSA-N
MW286.80 g/mol
LogP2.23
Rot. Bonds7

About N-(2-ethylphenyl)-2-(2-methoxyethylamino)propanamide;hydrochloride

N-(2-ethylphenyl)-2-(2-methoxyethylamino)propanamide;hydrochloride (PubChem CID 3025329) has the molecular formula C14H23ClN2O2 and a molecular weight of 286.80 g/mol. Its IUPAC name is N-(2-ethylphenyl)-2-(2-methoxyethylamino)propanamide;hydrochloride.

Molecular Properties

Compound NameN-(2-ethylphenyl)-2-(2-methoxyethylamino)propanamide;hydrochloride
PubChem CID3025329
Molecular FormulaC14H23ClN2O2
Molecular Weight286.80 g/mol
Exact Mass286.14
IUPAC NameN-(2-ethylphenyl)-2-(2-methoxyethylamino)propanamide;hydrochloride
SMILESCCc1ccccc1NC(=O)C(C)NCCOC.Cl
InChIInChI=1S/C14H22N2O2.ClH/c1-4-12-7-5-6-8-13(12)16-14(17)11(2)15-9-10-18-3;/h5-8,11,15H,4,9-10H2,1-3H3,(H,16,17);1H
InChIKeyAJVCSZSYJRGGIP-UHFFFAOYSA-N
XLogP2.23
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.80
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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-ethylphenyl)-2-(2-methoxyethylamino)propanamide;hydrochloride?
The IUPAC name of N-(2-ethylphenyl)-2-(2-methoxyethylamino)propanamide;hydrochloride (CID 3025329) is N-(2-ethylphenyl)-2-(2-methoxyethylamino)propanamide;hydrochloride.
What is the SMILES notation for N-(2-ethylphenyl)-2-(2-methoxyethylamino)propanamide;hydrochloride?
The canonical SMILES for N-(2-ethylphenyl)-2-(2-methoxyethylamino)propanamide;hydrochloride is CCc1ccccc1NC(=O)C(C)NCCOC.Cl.
What is the InChIKey of N-(2-ethylphenyl)-2-(2-methoxyethylamino)propanamide;hydrochloride?
The InChIKey is AJVCSZSYJRGGIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2.ClH/c1-4-12-7-5-6-8-13(12)16-14(17)11(2)15-9-10-18-3;/h5-8,11,15H,4,9-10H2,1-3H3,(H,16,17);1H.
What are the key properties of N-(2-ethylphenyl)-2-(2-methoxyethylamino)propanamide;hydrochloride?
N-(2-ethylphenyl)-2-(2-methoxyethylamino)propanamide;hydrochloride has a molecular weight of 286.80 g/mol, XLogP of 2.23, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylphenyl)-2-(2-methoxyethylamino)propanamide;hydrochloride is sourced from PubChem (CID 3025329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).