2-(2-ethoxyethylamino)-N-(2-methylphenyl)propanamide

C14H22N2O2 — CID 3051084

IUPAC2-(2-ethoxyethylamino)-N-(2-methylphenyl)propanamide
SMILESCCOCCNC(C)C(=O)Nc1ccccc1C
InChIInChI=1S/C14H22N2O2/c1-4-18-10-9-15-12(3)14(17)16-13-8-6-5-7-11(13)2/h5-8,12,15H,4,9-10H2,1-3H3,(H,16,17)
InChIKeySCEHLWZJEBLAHY-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.95
Rot. Bonds7

About 2-(2-ethoxyethylamino)-N-(2-methylphenyl)propanamide

2-(2-ethoxyethylamino)-N-(2-methylphenyl)propanamide (PubChem CID 3051084) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 2-(2-ethoxyethylamino)-N-(2-methylphenyl)propanamide.

Molecular Properties

Compound Name2-(2-ethoxyethylamino)-N-(2-methylphenyl)propanamide
PubChem CID3051084
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name2-(2-ethoxyethylamino)-N-(2-methylphenyl)propanamide
SMILESCCOCCNC(C)C(=O)Nc1ccccc1C
InChIInChI=1S/C14H22N2O2/c1-4-18-10-9-15-12(3)14(17)16-13-8-6-5-7-11(13)2/h5-8,12,15H,4,9-10H2,1-3H3,(H,16,17)
InChIKeySCEHLWZJEBLAHY-UHFFFAOYSA-N
XLogP1.95
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.95
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 2-(2-ethoxyethylamino)-N-(2-methylphenyl)propanamide?
The IUPAC name of 2-(2-ethoxyethylamino)-N-(2-methylphenyl)propanamide (CID 3051084) is 2-(2-ethoxyethylamino)-N-(2-methylphenyl)propanamide.
What is the SMILES notation for 2-(2-ethoxyethylamino)-N-(2-methylphenyl)propanamide?
The canonical SMILES for 2-(2-ethoxyethylamino)-N-(2-methylphenyl)propanamide is CCOCCNC(C)C(=O)Nc1ccccc1C.
What is the InChIKey of 2-(2-ethoxyethylamino)-N-(2-methylphenyl)propanamide?
The InChIKey is SCEHLWZJEBLAHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-4-18-10-9-15-12(3)14(17)16-13-8-6-5-7-11(13)2/h5-8,12,15H,4,9-10H2,1-3H3,(H,16,17).
What are the key properties of 2-(2-ethoxyethylamino)-N-(2-methylphenyl)propanamide?
2-(2-ethoxyethylamino)-N-(2-methylphenyl)propanamide has a molecular weight of 250.34 g/mol, XLogP of 1.95, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethoxyethylamino)-N-(2-methylphenyl)propanamide is sourced from PubChem (CID 3051084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).