N'-[2-(4-fluorophenyl)ethyl]-N-(2-phenylethyl)oxamide

C18H19FN2O2 — CID 3117526

IUPACN'-[2-(4-fluorophenyl)ethyl]-N-(2-phenylethyl)oxamide
SMILESO=C(NCCc1ccccc1)C(=O)NCCc1ccc(F)cc1
InChIInChI=1S/C18H19FN2O2/c19-16-8-6-15(7-9-16)11-13-21-18(23)17(22)20-12-10-14-4-2-1-3-5-14/h1-9H,10-13H2,(H,20,22)(H,21,23)
InChIKeyUZULNNGTMJRLIH-UHFFFAOYSA-N
MW314.36 g/mol
LogP1.84
Rot. Bonds6

About N'-[2-(4-fluorophenyl)ethyl]-N-(2-phenylethyl)oxamide

N'-[2-(4-fluorophenyl)ethyl]-N-(2-phenylethyl)oxamide (PubChem CID 3117526) has the molecular formula C18H19FN2O2 and a molecular weight of 314.36 g/mol. Its IUPAC name is N'-[2-(4-fluorophenyl)ethyl]-N-(2-phenylethyl)oxamide.

Molecular Properties

Compound NameN'-[2-(4-fluorophenyl)ethyl]-N-(2-phenylethyl)oxamide
PubChem CID3117526
Molecular FormulaC18H19FN2O2
Molecular Weight314.36 g/mol
Exact Mass314.14
IUPAC NameN'-[2-(4-fluorophenyl)ethyl]-N-(2-phenylethyl)oxamide
SMILESO=C(NCCc1ccccc1)C(=O)NCCc1ccc(F)cc1
InChIInChI=1S/C18H19FN2O2/c19-16-8-6-15(7-9-16)11-13-21-18(23)17(22)20-12-10-14-4-2-1-3-5-14/h1-9H,10-13H2,(H,20,22)(H,21,23)
InChIKeyUZULNNGTMJRLIH-UHFFFAOYSA-N
XLogP1.84
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.36
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(4-fluorophenyl)ethyl]-4-phenylbutanamide
CID 2288121
N-[2-(4-fluorophenyl)ethyl]-3-(2-phenylethylamino)propanamide
CID 109024236
1,1-dibenzyl-3-[2-(4-fluorophenyl)ethyl]urea
CID 108902120
2-(4-fluorophenyl)-N-[2-oxo-2-(2-phenylethylamino)ethyl]acetamide
CID 112993239
(Z)-2,3-dichloro-4-[2-(4-fluorophenyl)ethylamino]-4-oxobut-2-enoic acid
CID 86741528
N-[2-(4-fluorophenyl)ethyl]-N'-(3-methylbutyl)oxamide
CID 108531969
(3R,4R)-3-N-[2-(4-fluorophenyl)ethyl]-4-N-(2-phenylethyl)pyrrolidine-3,4-dicarboxamide
CID 154961335
(Z)-2-cyano-3-[2-(4-fluorophenyl)ethylamino]-N-(2-phenylethyl)prop-2-enamide
CID 108835304
methyl 2-[2-(4-fluorophenyl)ethylamino]-2-oxoacetate
CID 112616592
N-[(4-fluorophenyl)methyl]-2-(2-phenylethylamino)acetamide
CID 108997842
2-(4-fluorophenyl)-2-methyl-N-(2-phenylethyl)propanamide
CID 113197365
N'-(2,4-difluorophenyl)-N-[2-(4-fluorophenyl)ethyl]oxamide
CID 7292792

Frequently Asked Questions

What is the IUPAC name of N'-[2-(4-fluorophenyl)ethyl]-N-(2-phenylethyl)oxamide?
The IUPAC name of N'-[2-(4-fluorophenyl)ethyl]-N-(2-phenylethyl)oxamide (CID 3117526) is N'-[2-(4-fluorophenyl)ethyl]-N-(2-phenylethyl)oxamide.
What is the SMILES notation for N'-[2-(4-fluorophenyl)ethyl]-N-(2-phenylethyl)oxamide?
The canonical SMILES for N'-[2-(4-fluorophenyl)ethyl]-N-(2-phenylethyl)oxamide is O=C(NCCc1ccccc1)C(=O)NCCc1ccc(F)cc1.
What is the InChIKey of N'-[2-(4-fluorophenyl)ethyl]-N-(2-phenylethyl)oxamide?
The InChIKey is UZULNNGTMJRLIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN2O2/c19-16-8-6-15(7-9-16)11-13-21-18(23)17(22)20-12-10-14-4-2-1-3-5-14/h1-9H,10-13H2,(H,20,22)(H,21,23).
What are the key properties of N'-[2-(4-fluorophenyl)ethyl]-N-(2-phenylethyl)oxamide?
N'-[2-(4-fluorophenyl)ethyl]-N-(2-phenylethyl)oxamide has a molecular weight of 314.36 g/mol, XLogP of 1.84, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(4-fluorophenyl)ethyl]-N-(2-phenylethyl)oxamide is sourced from PubChem (CID 3117526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).