2-[benzyl(ethyl)amino]-N-[2-(4-fluorophenyl)ethyl]acetamide

C19H23FN2O — CID 78787355

IUPAC2-[benzyl(ethyl)amino]-N-[2-(4-fluorophenyl)ethyl]acetamide
SMILESCCN(CC(=O)NCCc1ccc(F)cc1)Cc1ccccc1
InChIInChI=1S/C19H23FN2O/c1-2-22(14-17-6-4-3-5-7-17)15-19(23)21-13-12-16-8-10-18(20)11-9-16/h3-11H,2,12-15H2,1H3,(H,21,23)
InChIKeyVFXCPJWLIMIORC-UHFFFAOYSA-N
MW314.40 g/mol
LogP3.01
Rot. Bonds8

About 2-[benzyl(ethyl)amino]-N-[2-(4-fluorophenyl)ethyl]acetamide

2-[benzyl(ethyl)amino]-N-[2-(4-fluorophenyl)ethyl]acetamide (PubChem CID 78787355) has the molecular formula C19H23FN2O and a molecular weight of 314.40 g/mol. Its IUPAC name is 2-[benzyl(ethyl)amino]-N-[2-(4-fluorophenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-[benzyl(ethyl)amino]-N-[2-(4-fluorophenyl)ethyl]acetamide
PubChem CID78787355
Molecular FormulaC19H23FN2O
Molecular Weight314.40 g/mol
Exact Mass314.18
IUPAC Name2-[benzyl(ethyl)amino]-N-[2-(4-fluorophenyl)ethyl]acetamide
SMILESCCN(CC(=O)NCCc1ccc(F)cc1)Cc1ccccc1
InChIInChI=1S/C19H23FN2O/c1-2-22(14-17-6-4-3-5-7-17)15-19(23)21-13-12-16-8-10-18(20)11-9-16/h3-11H,2,12-15H2,1H3,(H,21,23)
InChIKeyVFXCPJWLIMIORC-UHFFFAOYSA-N
XLogP3.01
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.40
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[ethyl(2-hydroxyethyl)amino]-N-[2-(4-fluorophenyl)ethyl]acetamide
CID 60685466
2-[ethyl-[(3-fluoro-4-methoxyphenyl)methyl]amino]-N-[2-(4-fluorophenyl)ethyl]acetamide
CID 18191553
2-[(4-fluorophenyl)methyl-methylsulfonylamino]-N-(2-phenylethyl)acetamide
CID 113150994
2-[(3,4-dimethoxyphenyl)methyl-ethylamino]-N-(2-phenylethyl)acetamide
CID 32663206
2-[benzyl(methyl)amino]-N-(2-phenylethyl)acetamide
CID 54808729
N-benzyl-N-ethyl-N'-[2-(4-fluorophenyl)ethyl]-2,2-dimethylpropanediamide
CID 108963223
2-[ethyl(3-hydroxypropyl)amino]-N-(2-phenylethyl)acetamide
CID 115666394
methyl 3-[[2-[benzyl(ethyl)amino]acetyl]amino]propanoate
CID 78815356
2-[benzyl(ethyl)amino]-N-(3-methoxypropyl)acetamide
CID 78787360
1,1-dibenzyl-3-[2-(4-fluorophenyl)ethyl]urea
CID 108902120
2-[benzyl(ethyl)amino]-1-(4-fluorophenyl)ethanone
CID 60649817
N-[2-(4-fluorophenyl)ethyl]-2-[N-(2-hydroxyethyl)anilino]acetamide
CID 110877219

Frequently Asked Questions

What is the IUPAC name of 2-[benzyl(ethyl)amino]-N-[2-(4-fluorophenyl)ethyl]acetamide?
The IUPAC name of 2-[benzyl(ethyl)amino]-N-[2-(4-fluorophenyl)ethyl]acetamide (CID 78787355) is 2-[benzyl(ethyl)amino]-N-[2-(4-fluorophenyl)ethyl]acetamide.
What is the SMILES notation for 2-[benzyl(ethyl)amino]-N-[2-(4-fluorophenyl)ethyl]acetamide?
The canonical SMILES for 2-[benzyl(ethyl)amino]-N-[2-(4-fluorophenyl)ethyl]acetamide is CCN(CC(=O)NCCc1ccc(F)cc1)Cc1ccccc1.
What is the InChIKey of 2-[benzyl(ethyl)amino]-N-[2-(4-fluorophenyl)ethyl]acetamide?
The InChIKey is VFXCPJWLIMIORC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23FN2O/c1-2-22(14-17-6-4-3-5-7-17)15-19(23)21-13-12-16-8-10-18(20)11-9-16/h3-11H,2,12-15H2,1H3,(H,21,23).
What are the key properties of 2-[benzyl(ethyl)amino]-N-[2-(4-fluorophenyl)ethyl]acetamide?
2-[benzyl(ethyl)amino]-N-[2-(4-fluorophenyl)ethyl]acetamide has a molecular weight of 314.40 g/mol, XLogP of 3.01, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[benzyl(ethyl)amino]-N-[2-(4-fluorophenyl)ethyl]acetamide is sourced from PubChem (CID 78787355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).