2-[2-(2-fluorophenyl)ethylamino]-N-[2-(2-methoxyphenyl)ethyl]acetamide

C19H23FN2O2 — CID 109000124

IUPAC2-[2-(2-fluorophenyl)ethylamino]-N-[2-(2-methoxyphenyl)ethyl]acetamide
SMILESCOc1ccccc1CCNC(=O)CNCCc1ccccc1F
InChIInChI=1S/C19H23FN2O2/c1-24-18-9-5-3-7-16(18)11-13-22-19(23)14-21-12-10-15-6-2-4-8-17(15)20/h2-9,21H,10-14H2,1H3,(H,22,23)
InChIKeySLLXYPRBSXEVDH-UHFFFAOYSA-N
MW330.40 g/mol
LogP2.33
Rot. Bonds9

About 2-[2-(2-fluorophenyl)ethylamino]-N-[2-(2-methoxyphenyl)ethyl]acetamide

2-[2-(2-fluorophenyl)ethylamino]-N-[2-(2-methoxyphenyl)ethyl]acetamide (PubChem CID 109000124) has the molecular formula C19H23FN2O2 and a molecular weight of 330.40 g/mol. Its IUPAC name is 2-[2-(2-fluorophenyl)ethylamino]-N-[2-(2-methoxyphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-[2-(2-fluorophenyl)ethylamino]-N-[2-(2-methoxyphenyl)ethyl]acetamide
PubChem CID109000124
Molecular FormulaC19H23FN2O2
Molecular Weight330.40 g/mol
Exact Mass330.17
IUPAC Name2-[2-(2-fluorophenyl)ethylamino]-N-[2-(2-methoxyphenyl)ethyl]acetamide
SMILESCOc1ccccc1CCNC(=O)CNCCc1ccccc1F
InChIInChI=1S/C19H23FN2O2/c1-24-18-9-5-3-7-16(18)11-13-22-19(23)14-21-12-10-15-6-2-4-8-17(15)20/h2-9,21H,10-14H2,1H3,(H,22,23)
InChIKeySLLXYPRBSXEVDH-UHFFFAOYSA-N
XLogP2.33
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.40
LogP ≤ 52.33
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-(2-fluorophenyl)ethylamino]-N-[2-(2-methoxyphenyl)ethyl]acetamide?
The IUPAC name of 2-[2-(2-fluorophenyl)ethylamino]-N-[2-(2-methoxyphenyl)ethyl]acetamide (CID 109000124) is 2-[2-(2-fluorophenyl)ethylamino]-N-[2-(2-methoxyphenyl)ethyl]acetamide.
What is the SMILES notation for 2-[2-(2-fluorophenyl)ethylamino]-N-[2-(2-methoxyphenyl)ethyl]acetamide?
The canonical SMILES for 2-[2-(2-fluorophenyl)ethylamino]-N-[2-(2-methoxyphenyl)ethyl]acetamide is COc1ccccc1CCNC(=O)CNCCc1ccccc1F.
What is the InChIKey of 2-[2-(2-fluorophenyl)ethylamino]-N-[2-(2-methoxyphenyl)ethyl]acetamide?
The InChIKey is SLLXYPRBSXEVDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23FN2O2/c1-24-18-9-5-3-7-16(18)11-13-22-19(23)14-21-12-10-15-6-2-4-8-17(15)20/h2-9,21H,10-14H2,1H3,(H,22,23).
What are the key properties of 2-[2-(2-fluorophenyl)ethylamino]-N-[2-(2-methoxyphenyl)ethyl]acetamide?
2-[2-(2-fluorophenyl)ethylamino]-N-[2-(2-methoxyphenyl)ethyl]acetamide has a molecular weight of 330.40 g/mol, XLogP of 2.33, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-fluorophenyl)ethylamino]-N-[2-(2-methoxyphenyl)ethyl]acetamide is sourced from PubChem (CID 109000124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).