3-[2-(2-fluorophenyl)ethylamino]-N-(2-methoxyethyl)propanamide

C14H21FN2O2 — CID 109015003

IUPAC3-[2-(2-fluorophenyl)ethylamino]-N-(2-methoxyethyl)propanamide
SMILESCOCCNC(=O)CCNCCc1ccccc1F
InChIInChI=1S/C14H21FN2O2/c1-19-11-10-17-14(18)7-9-16-8-6-12-4-2-3-5-13(12)15/h2-5,16H,6-11H2,1H3,(H,17,18)
InChIKeySOIJYFNYOYRUHJ-UHFFFAOYSA-N
MW268.33 g/mol
LogP1.11
Rot. Bonds9

About 3-[2-(2-fluorophenyl)ethylamino]-N-(2-methoxyethyl)propanamide

3-[2-(2-fluorophenyl)ethylamino]-N-(2-methoxyethyl)propanamide (PubChem CID 109015003) has the molecular formula C14H21FN2O2 and a molecular weight of 268.33 g/mol. Its IUPAC name is 3-[2-(2-fluorophenyl)ethylamino]-N-(2-methoxyethyl)propanamide.

Molecular Properties

Compound Name3-[2-(2-fluorophenyl)ethylamino]-N-(2-methoxyethyl)propanamide
PubChem CID109015003
Molecular FormulaC14H21FN2O2
Molecular Weight268.33 g/mol
Exact Mass268.16
IUPAC Name3-[2-(2-fluorophenyl)ethylamino]-N-(2-methoxyethyl)propanamide
SMILESCOCCNC(=O)CCNCCc1ccccc1F
InChIInChI=1S/C14H21FN2O2/c1-19-11-10-17-14(18)7-9-16-8-6-12-4-2-3-5-13(12)15/h2-5,16H,6-11H2,1H3,(H,17,18)
InChIKeySOIJYFNYOYRUHJ-UHFFFAOYSA-N
XLogP1.11
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.33
LogP ≤ 51.11
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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Related Compounds

3-[2-(2-fluorophenyl)ethylamino]-N-[(2-methoxyphenyl)methyl]propanamide
CID 109021953
3-[(2,3-difluorophenyl)methylamino]-N-(2-methoxyethyl)propanamide
CID 115618231
3-[(2-fluorophenyl)methylamino]-N-(3-methoxypropyl)propanamide
CID 109015344
3-[(3-fluoro-2-hydroxyphenyl)methylamino]-N-(2-methoxyethyl)propanamide
CID 115972838
3-[acetyl-[2-(2-fluorophenyl)ethyl]amino]-N-(2-methoxyethyl)propanamide
CID 113120912
N-[2-(4-fluorophenyl)ethyl]-3-[2-(2-fluorophenyl)ethylamino]propanamide
CID 109024783
N-[(2-fluorophenyl)methyl]-3-[2-(2-methoxyphenyl)ethylamino]propanamide
CID 109020694
3-[3-(dimethylamino)propylamino]-N-[2-(2-fluorophenyl)ethyl]propanamide
CID 109017050
2-(2-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]acetamide
CID 78792118
3-[(2-bromophenyl)methylamino]-N-(2-methoxyethyl)propanamide
CID 112686507
N-(2-ethylphenyl)-3-[2-(2-fluorophenyl)ethylamino]propanamide
CID 109024840
2-(2,3-difluorophenyl)-N-[2-(2-methoxyethylamino)ethyl]acetamide
CID 82994529

Frequently Asked Questions

What is the IUPAC name of 3-[2-(2-fluorophenyl)ethylamino]-N-(2-methoxyethyl)propanamide?
The IUPAC name of 3-[2-(2-fluorophenyl)ethylamino]-N-(2-methoxyethyl)propanamide (CID 109015003) is 3-[2-(2-fluorophenyl)ethylamino]-N-(2-methoxyethyl)propanamide.
What is the SMILES notation for 3-[2-(2-fluorophenyl)ethylamino]-N-(2-methoxyethyl)propanamide?
The canonical SMILES for 3-[2-(2-fluorophenyl)ethylamino]-N-(2-methoxyethyl)propanamide is COCCNC(=O)CCNCCc1ccccc1F.
What is the InChIKey of 3-[2-(2-fluorophenyl)ethylamino]-N-(2-methoxyethyl)propanamide?
The InChIKey is SOIJYFNYOYRUHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21FN2O2/c1-19-11-10-17-14(18)7-9-16-8-6-12-4-2-3-5-13(12)15/h2-5,16H,6-11H2,1H3,(H,17,18).
What are the key properties of 3-[2-(2-fluorophenyl)ethylamino]-N-(2-methoxyethyl)propanamide?
3-[2-(2-fluorophenyl)ethylamino]-N-(2-methoxyethyl)propanamide has a molecular weight of 268.33 g/mol, XLogP of 1.11, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(2-fluorophenyl)ethylamino]-N-(2-methoxyethyl)propanamide is sourced from PubChem (CID 109015003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).