N-(2,4-difluorophenyl)-N'-[(1R)-1-phenylethyl]oxamide

C16H14F2N2O2 — CID 7393082

IUPACN-(2,4-difluorophenyl)-N'-[(1R)-1-phenylethyl]oxamide
SMILESC[C@@H](NC(=O)C(=O)Nc1ccc(F)cc1F)c1ccccc1
InChIInChI=1S/C16H14F2N2O2/c1-10(11-5-3-2-4-6-11)19-15(21)16(22)20-14-8-7-12(17)9-13(14)18/h2-10H,1H3,(H,19,21)(H,20,22)/t10-/m1/s1
InChIKeyRDFSGTZJVSQGGO-SNVBAGLBSA-N
MW304.30 g/mol
LogP2.78
Rot. Bonds3

About N-(2,4-difluorophenyl)-N'-[(1R)-1-phenylethyl]oxamide

N-(2,4-difluorophenyl)-N'-[(1R)-1-phenylethyl]oxamide (PubChem CID 7393082) has the molecular formula C16H14F2N2O2 and a molecular weight of 304.30 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-N'-[(1R)-1-phenylethyl]oxamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-N'-[(1R)-1-phenylethyl]oxamide
PubChem CID7393082
Molecular FormulaC16H14F2N2O2
Molecular Weight304.30 g/mol
Exact Mass304.10
IUPAC NameN-(2,4-difluorophenyl)-N'-[(1R)-1-phenylethyl]oxamide
SMILESC[C@@H](NC(=O)C(=O)Nc1ccc(F)cc1F)c1ccccc1
InChIInChI=1S/C16H14F2N2O2/c1-10(11-5-3-2-4-6-11)19-15(21)16(22)20-14-8-7-12(17)9-13(14)18/h2-10H,1H3,(H,19,21)(H,20,22)/t10-/m1/s1
InChIKeyRDFSGTZJVSQGGO-SNVBAGLBSA-N
XLogP2.78
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.30
LogP ≤ 52.78
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-(2,5-difluorophenyl)-N'-(1-phenylethyl)oxamide
CID 44998519
1-(2,4-difluorophenyl)-3-[(1R)-1-phenylethyl]urea
CID 51579251
1-N-(2,4-difluorophenyl)-3-N-(1-phenylethyl)benzene-1,3-dicarboxamide
CID 109054492
N'-[(1R)-1-(4-fluorophenyl)ethyl]-N-[(1R)-1-phenylethyl]oxamide
CID 30405081
N-(2,4-difluorophenyl)-N'-[1-(2-fluorophenyl)propan-2-yl]oxamide
CID 86831524
N-(2,5-difluorophenyl)-N'-[1-(4-ethylphenyl)ethyl]oxamide
CID 108511128
N-(2-chlorophenyl)-N'-[(1R)-1-phenylethyl]oxamide
CID 2291188
[(2R)-1-(2,4-difluoroanilino)-1-oxopropan-2-yl]-[(1S)-1-phenylethyl]azanium
CID 9248668
[2-(2,4-difluoroanilino)-2-oxoethyl]-[(1R)-1-phenylethyl]azanium
CID 2684101
N-(2,4-difluorophenyl)-N'-(1-hydroxy-4-methylpentan-2-yl)oxamide
CID 111798025
1-(2,4-difluorophenyl)-3-[(1S)-1-(4-fluorophenyl)ethyl]thiourea
CID 92512962
1-(5-fluoro-2-methylphenyl)-3-[(1S)-1-phenylethyl]urea
CID 51944551

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-N'-[(1R)-1-phenylethyl]oxamide?
The IUPAC name of N-(2,4-difluorophenyl)-N'-[(1R)-1-phenylethyl]oxamide (CID 7393082) is N-(2,4-difluorophenyl)-N'-[(1R)-1-phenylethyl]oxamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-N'-[(1R)-1-phenylethyl]oxamide?
The canonical SMILES for N-(2,4-difluorophenyl)-N'-[(1R)-1-phenylethyl]oxamide is C[C@@H](NC(=O)C(=O)Nc1ccc(F)cc1F)c1ccccc1.
What is the InChIKey of N-(2,4-difluorophenyl)-N'-[(1R)-1-phenylethyl]oxamide?
The InChIKey is RDFSGTZJVSQGGO-SNVBAGLBSA-N. The full InChI is InChI=1S/C16H14F2N2O2/c1-10(11-5-3-2-4-6-11)19-15(21)16(22)20-14-8-7-12(17)9-13(14)18/h2-10H,1H3,(H,19,21)(H,20,22)/t10-/m1/s1.
What are the key properties of N-(2,4-difluorophenyl)-N'-[(1R)-1-phenylethyl]oxamide?
N-(2,4-difluorophenyl)-N'-[(1R)-1-phenylethyl]oxamide has a molecular weight of 304.30 g/mol, XLogP of 2.78, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-N'-[(1R)-1-phenylethyl]oxamide is sourced from PubChem (CID 7393082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).