N-(2-ethylphenyl)-N'-(2-hydroxy-1-phenylethyl)oxamide

C18H20N2O3 — CID 111798095

IUPACN-(2-ethylphenyl)-N'-(2-hydroxy-1-phenylethyl)oxamide
SMILESCCc1ccccc1NC(=O)C(=O)NC(CO)c1ccccc1
InChIInChI=1S/C18H20N2O3/c1-2-13-8-6-7-11-15(13)19-17(22)18(23)20-16(12-21)14-9-4-3-5-10-14/h3-11,16,21H,2,12H2,1H3,(H,19,22)(H,20,23)
InChIKeyACDRPDDFYHNCAZ-UHFFFAOYSA-N
MW312.37 g/mol
LogP2.04
Rot. Bonds5

About N-(2-ethylphenyl)-N'-(2-hydroxy-1-phenylethyl)oxamide

N-(2-ethylphenyl)-N'-(2-hydroxy-1-phenylethyl)oxamide (PubChem CID 111798095) has the molecular formula C18H20N2O3 and a molecular weight of 312.37 g/mol. Its IUPAC name is N-(2-ethylphenyl)-N'-(2-hydroxy-1-phenylethyl)oxamide.

Molecular Properties

Compound NameN-(2-ethylphenyl)-N'-(2-hydroxy-1-phenylethyl)oxamide
PubChem CID111798095
Molecular FormulaC18H20N2O3
Molecular Weight312.37 g/mol
Exact Mass312.15
IUPAC NameN-(2-ethylphenyl)-N'-(2-hydroxy-1-phenylethyl)oxamide
SMILESCCc1ccccc1NC(=O)C(=O)NC(CO)c1ccccc1
InChIInChI=1S/C18H20N2O3/c1-2-13-8-6-7-11-15(13)19-17(22)18(23)20-16(12-21)14-9-4-3-5-10-14/h3-11,16,21H,2,12H2,1H3,(H,19,22)(H,20,23)
InChIKeyACDRPDDFYHNCAZ-UHFFFAOYSA-N
XLogP2.04
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 52.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-(2-ethylphenyl)-3-(2-hydroxy-1-phenylethyl)urea
CID 110895839
N-(2,6-difluorophenyl)-N'-[(1S)-2-hydroxy-1-phenylethyl]oxamide
CID 111798649
3-amino-N-(2-ethylphenyl)-2-phenylpropanamide
CID 62878156
(2S)-2-chloro-N-(2-ethylphenyl)-2-phenylacetamide
CID 40554368
(2R)-2-chloro-N-(2-ethylphenyl)-2-phenylacetamide
CID 40554367
1-(2-fluorophenyl)-3-[(1R)-2-hydroxy-1-phenylethyl]urea
CID 103765021
N-(2,3-dimethylphenyl)-N'-(3-hydroxy-1-phenylpropyl)oxamide
CID 111798272
2-(2-ethylanilino)-2-oxoacetyl chloride
CID 87858291
N-(3-fluorophenyl)-N'-(2-hydroxy-1-phenylethyl)oxamide
CID 111798119
N-(2-hydroxy-1-phenylethyl)butanamide
CID 63184192
2-fluoro-N-[(1S)-2-hydroxy-1-phenylethyl]prop-2-enamide
CID 167776266
2-amino-N-(2-hydroxy-1-phenylethyl)propanamide
CID 63183565

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylphenyl)-N'-(2-hydroxy-1-phenylethyl)oxamide?
The IUPAC name of N-(2-ethylphenyl)-N'-(2-hydroxy-1-phenylethyl)oxamide (CID 111798095) is N-(2-ethylphenyl)-N'-(2-hydroxy-1-phenylethyl)oxamide.
What is the SMILES notation for N-(2-ethylphenyl)-N'-(2-hydroxy-1-phenylethyl)oxamide?
The canonical SMILES for N-(2-ethylphenyl)-N'-(2-hydroxy-1-phenylethyl)oxamide is CCc1ccccc1NC(=O)C(=O)NC(CO)c1ccccc1.
What is the InChIKey of N-(2-ethylphenyl)-N'-(2-hydroxy-1-phenylethyl)oxamide?
The InChIKey is ACDRPDDFYHNCAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O3/c1-2-13-8-6-7-11-15(13)19-17(22)18(23)20-16(12-21)14-9-4-3-5-10-14/h3-11,16,21H,2,12H2,1H3,(H,19,22)(H,20,23).
What are the key properties of N-(2-ethylphenyl)-N'-(2-hydroxy-1-phenylethyl)oxamide?
N-(2-ethylphenyl)-N'-(2-hydroxy-1-phenylethyl)oxamide has a molecular weight of 312.37 g/mol, XLogP of 2.04, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylphenyl)-N'-(2-hydroxy-1-phenylethyl)oxamide is sourced from PubChem (CID 111798095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).