N-(2,6-diethylphenyl)-2-[2-(4-fluorophenyl)ethylamino]acetamide

C20H25FN2O — CID 109000450

IUPACN-(2,6-diethylphenyl)-2-[2-(4-fluorophenyl)ethylamino]acetamide
SMILESCCc1cccc(CC)c1NC(=O)CNCCc1ccc(F)cc1
InChIInChI=1S/C20H25FN2O/c1-3-16-6-5-7-17(4-2)20(16)23-19(24)14-22-13-12-15-8-10-18(21)11-9-15/h5-11,22H,3-4,12-14H2,1-2H3,(H,23,24)
InChIKeySKYULUKSSQGZHF-UHFFFAOYSA-N
MW328.43 g/mol
LogP3.72
Rot. Bonds8

About N-(2,6-diethylphenyl)-2-[2-(4-fluorophenyl)ethylamino]acetamide

N-(2,6-diethylphenyl)-2-[2-(4-fluorophenyl)ethylamino]acetamide (PubChem CID 109000450) has the molecular formula C20H25FN2O and a molecular weight of 328.43 g/mol. Its IUPAC name is N-(2,6-diethylphenyl)-2-[2-(4-fluorophenyl)ethylamino]acetamide.

Molecular Properties

Compound NameN-(2,6-diethylphenyl)-2-[2-(4-fluorophenyl)ethylamino]acetamide
PubChem CID109000450
Molecular FormulaC20H25FN2O
Molecular Weight328.43 g/mol
Exact Mass328.20
IUPAC NameN-(2,6-diethylphenyl)-2-[2-(4-fluorophenyl)ethylamino]acetamide
SMILESCCc1cccc(CC)c1NC(=O)CNCCc1ccc(F)cc1
InChIInChI=1S/C20H25FN2O/c1-3-16-6-5-7-17(4-2)20(16)23-19(24)14-22-13-12-15-8-10-18(21)11-9-15/h5-11,22H,3-4,12-14H2,1-2H3,(H,23,24)
InChIKeySKYULUKSSQGZHF-UHFFFAOYSA-N
XLogP3.72
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.43
LogP ≤ 53.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(2,6-diethylphenyl)-2-[2-(4-methoxyphenyl)ethylamino]acetamide
CID 109001189
3-(2,6-diethylanilino)-N-[2-(4-fluorophenyl)ethyl]propanamide
CID 109024995
N-(2,6-difluorophenyl)-2-[2-(4-methoxyphenyl)ethylamino]acetamide
CID 109001267
N-(3-bromophenyl)-2-[2-(4-fluorophenyl)ethylamino]acetamide
CID 29271657
N-(2,6-diethylphenyl)-2-[(4-fluorophenyl)sulfonylamino]acetamide
CID 112997342
N-(2-ethyl-6-methylphenyl)-2-[(4-fluorophenyl)methylsulfanyl]acetamide
CID 28631186
N-(2-tert-butylphenyl)-2-[2-(4-fluorophenyl)ethylamino]acetamide
CID 109000452
N-(2,6-diethylphenyl)-3-(4-methylphenyl)propanamide
CID 19220419
N-[2-(4-fluorophenyl)ethyl]-2-(propylamino)acetamide
CID 60648420
N-(2,6-diethylphenyl)-2-(2,6-difluoroanilino)acetamide
CID 109008077
2-[2-(4-fluorophenyl)ethylamino]-N-(4-propan-2-ylphenyl)acetamide
CID 109000448
N-(2,6-dimethylphenyl)-2-[2-(2-fluorophenyl)ethylamino]acetamide
CID 109000172

Frequently Asked Questions

What is the IUPAC name of N-(2,6-diethylphenyl)-2-[2-(4-fluorophenyl)ethylamino]acetamide?
The IUPAC name of N-(2,6-diethylphenyl)-2-[2-(4-fluorophenyl)ethylamino]acetamide (CID 109000450) is N-(2,6-diethylphenyl)-2-[2-(4-fluorophenyl)ethylamino]acetamide.
What is the SMILES notation for N-(2,6-diethylphenyl)-2-[2-(4-fluorophenyl)ethylamino]acetamide?
The canonical SMILES for N-(2,6-diethylphenyl)-2-[2-(4-fluorophenyl)ethylamino]acetamide is CCc1cccc(CC)c1NC(=O)CNCCc1ccc(F)cc1.
What is the InChIKey of N-(2,6-diethylphenyl)-2-[2-(4-fluorophenyl)ethylamino]acetamide?
The InChIKey is SKYULUKSSQGZHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25FN2O/c1-3-16-6-5-7-17(4-2)20(16)23-19(24)14-22-13-12-15-8-10-18(21)11-9-15/h5-11,22H,3-4,12-14H2,1-2H3,(H,23,24).
What are the key properties of N-(2,6-diethylphenyl)-2-[2-(4-fluorophenyl)ethylamino]acetamide?
N-(2,6-diethylphenyl)-2-[2-(4-fluorophenyl)ethylamino]acetamide has a molecular weight of 328.43 g/mol, XLogP of 3.72, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-diethylphenyl)-2-[2-(4-fluorophenyl)ethylamino]acetamide is sourced from PubChem (CID 109000450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).