N-(4-acetylphenyl)-2-[2-(2-fluorophenyl)ethylamino]acetamide

C18H19FN2O2 — CID 109000209

IUPACN-(4-acetylphenyl)-2-[2-(2-fluorophenyl)ethylamino]acetamide
SMILESCC(=O)c1ccc(NC(=O)CNCCc2ccccc2F)cc1
InChIInChI=1S/C18H19FN2O2/c1-13(22)14-6-8-16(9-7-14)21-18(23)12-20-11-10-15-4-2-3-5-17(15)19/h2-9,20H,10-12H2,1H3,(H,21,23)
InChIKeyNBMSXXQEEXHQPD-UHFFFAOYSA-N
MW314.36 g/mol
LogP2.80
Rot. Bonds7

About N-(4-acetylphenyl)-2-[2-(2-fluorophenyl)ethylamino]acetamide

N-(4-acetylphenyl)-2-[2-(2-fluorophenyl)ethylamino]acetamide (PubChem CID 109000209) has the molecular formula C18H19FN2O2 and a molecular weight of 314.36 g/mol. Its IUPAC name is N-(4-acetylphenyl)-2-[2-(2-fluorophenyl)ethylamino]acetamide.

Molecular Properties

Compound NameN-(4-acetylphenyl)-2-[2-(2-fluorophenyl)ethylamino]acetamide
PubChem CID109000209
Molecular FormulaC18H19FN2O2
Molecular Weight314.36 g/mol
Exact Mass314.14
IUPAC NameN-(4-acetylphenyl)-2-[2-(2-fluorophenyl)ethylamino]acetamide
SMILESCC(=O)c1ccc(NC(=O)CNCCc2ccccc2F)cc1
InChIInChI=1S/C18H19FN2O2/c1-13(22)14-6-8-16(9-7-14)21-18(23)12-20-11-10-15-4-2-3-5-17(15)19/h2-9,20H,10-12H2,1H3,(H,21,23)
InChIKeyNBMSXXQEEXHQPD-UHFFFAOYSA-N
XLogP2.80
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.36
LogP ≤ 52.80
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

N-(3-chloro-4-fluorophenyl)-2-[2-(2-fluorophenyl)ethylamino]acetamide
CID 109000189
N-(4-fluorophenyl)-2-[2-(2-methylphenyl)ethylamino]acetamide
CID 78915505
N-(2,6-dimethylphenyl)-2-[2-(2-fluorophenyl)ethylamino]acetamide
CID 109000172
1-[2-(2-fluorophenyl)ethylamino]propan-2-one
CID 115235072
2-[2-(2-fluorophenyl)ethylamino]-N-(2,3,4-trifluorophenyl)acetamide
CID 109000255
N-[(2-fluorophenyl)methyl]-4-[[2-(2-methoxyethylamino)acetyl]amino]benzamide
CID 119718423
N-(2,6-dichlorophenyl)-2-[2-(2-fluorophenyl)ethylamino]acetamide
CID 109000245
N-(4-acetylphenyl)-4-[2-(2-fluorophenyl)ethyl]piperazine-1-carboxamide
CID 113108987
methyl 4-[[2-[[2-(2-fluorophenyl)acetyl]amino]acetyl]amino]benzoate
CID 112999954
N-(4-acetylphenyl)-6-[2-(2-fluorophenyl)ethylamino]pyridazine-3-carboxamide
CID 109121967
N-(4-acetylphenyl)-2-(2-methylphenyl)acetamide
CID 24696355
3-[acetyl-[(2-fluorophenyl)methyl]amino]-N-(4-acetylphenyl)propanamide
CID 113119196

Frequently Asked Questions

What is the IUPAC name of N-(4-acetylphenyl)-2-[2-(2-fluorophenyl)ethylamino]acetamide?
The IUPAC name of N-(4-acetylphenyl)-2-[2-(2-fluorophenyl)ethylamino]acetamide (CID 109000209) is N-(4-acetylphenyl)-2-[2-(2-fluorophenyl)ethylamino]acetamide.
What is the SMILES notation for N-(4-acetylphenyl)-2-[2-(2-fluorophenyl)ethylamino]acetamide?
The canonical SMILES for N-(4-acetylphenyl)-2-[2-(2-fluorophenyl)ethylamino]acetamide is CC(=O)c1ccc(NC(=O)CNCCc2ccccc2F)cc1.
What is the InChIKey of N-(4-acetylphenyl)-2-[2-(2-fluorophenyl)ethylamino]acetamide?
The InChIKey is NBMSXXQEEXHQPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN2O2/c1-13(22)14-6-8-16(9-7-14)21-18(23)12-20-11-10-15-4-2-3-5-17(15)19/h2-9,20H,10-12H2,1H3,(H,21,23).
What are the key properties of N-(4-acetylphenyl)-2-[2-(2-fluorophenyl)ethylamino]acetamide?
N-(4-acetylphenyl)-2-[2-(2-fluorophenyl)ethylamino]acetamide has a molecular weight of 314.36 g/mol, XLogP of 2.80, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetylphenyl)-2-[2-(2-fluorophenyl)ethylamino]acetamide is sourced from PubChem (CID 109000209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).