N'-benzyl-N'-(2-hydroxyethyl)-N-(2-propan-2-ylphenyl)oxamide

C20H24N2O3 — CID 108500524

IUPACN'-benzyl-N'-(2-hydroxyethyl)-N-(2-propan-2-ylphenyl)oxamide
SMILESCC(C)c1ccccc1NC(=O)C(=O)N(CCO)Cc1ccccc1
InChIInChI=1S/C20H24N2O3/c1-15(2)17-10-6-7-11-18(17)21-19(24)20(25)22(12-13-23)14-16-8-4-3-5-9-16/h3-11,15,23H,12-14H2,1-2H3,(H,21,24)
InChIKeyFYUXJRWBQWDGAJ-UHFFFAOYSA-N
MW340.42 g/mol
LogP2.77
Rot. Bonds6

About N'-benzyl-N'-(2-hydroxyethyl)-N-(2-propan-2-ylphenyl)oxamide

N'-benzyl-N'-(2-hydroxyethyl)-N-(2-propan-2-ylphenyl)oxamide (PubChem CID 108500524) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is N'-benzyl-N'-(2-hydroxyethyl)-N-(2-propan-2-ylphenyl)oxamide.

Molecular Properties

Compound NameN'-benzyl-N'-(2-hydroxyethyl)-N-(2-propan-2-ylphenyl)oxamide
PubChem CID108500524
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC NameN'-benzyl-N'-(2-hydroxyethyl)-N-(2-propan-2-ylphenyl)oxamide
SMILESCC(C)c1ccccc1NC(=O)C(=O)N(CCO)Cc1ccccc1
InChIInChI=1S/C20H24N2O3/c1-15(2)17-10-6-7-11-18(17)21-19(24)20(25)22(12-13-23)14-16-8-4-3-5-9-16/h3-11,15,23H,12-14H2,1-2H3,(H,21,24)
InChIKeyFYUXJRWBQWDGAJ-UHFFFAOYSA-N
XLogP2.77
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N'-(2-hydroxyethyl)-N'-methyl-N-(2-propan-2-ylphenyl)oxamide
CID 108500546
1-benzyl-1-ethyl-3-(2-propan-2-ylphenyl)urea
CID 108989019
N'-benzyl-N,N,N'-tris(2-hydroxyethyl)oxamide
CID 108509868
N'-benzyl-N-ethyl-N'-(2-hydroxyethyl)oxamide
CID 108521418
N'-benzyl-N-(2,4-dichlorophenyl)-N'-(2-hydroxyethyl)oxamide
CID 108502823
2-[N-(2-hydroxyethyl)anilino]-N-(2-propan-2-ylphenyl)acetamide
CID 110880303
N-benzyl-N-(2-hydroxyethyl)-2-(propan-2-ylamino)acetamide
CID 54870765
N,N'-dibenzyl-N'-(2-hydroxyethyl)-N-methyloxamide
CID 108518757
N'-acetyl-N'-(2-aminoethyl)-N-(2-propan-2-ylphenyl)oxamide
CID 108500601
2-[benzyl(ethyl)amino]-N-(2-propan-2-ylphenyl)acetamide
CID 8541330
1-benzyl-1-(2-hydroxyethyl)-3-(4-propan-2-ylphenyl)urea
CID 110896720
N'-benzyl-N-(4-chloro-2-methoxy-5-methylphenyl)-N'-(2-hydroxyethyl)oxamide
CID 108523848

Frequently Asked Questions

What is the IUPAC name of N'-benzyl-N'-(2-hydroxyethyl)-N-(2-propan-2-ylphenyl)oxamide?
The IUPAC name of N'-benzyl-N'-(2-hydroxyethyl)-N-(2-propan-2-ylphenyl)oxamide (CID 108500524) is N'-benzyl-N'-(2-hydroxyethyl)-N-(2-propan-2-ylphenyl)oxamide.
What is the SMILES notation for N'-benzyl-N'-(2-hydroxyethyl)-N-(2-propan-2-ylphenyl)oxamide?
The canonical SMILES for N'-benzyl-N'-(2-hydroxyethyl)-N-(2-propan-2-ylphenyl)oxamide is CC(C)c1ccccc1NC(=O)C(=O)N(CCO)Cc1ccccc1.
What is the InChIKey of N'-benzyl-N'-(2-hydroxyethyl)-N-(2-propan-2-ylphenyl)oxamide?
The InChIKey is FYUXJRWBQWDGAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3/c1-15(2)17-10-6-7-11-18(17)21-19(24)20(25)22(12-13-23)14-16-8-4-3-5-9-16/h3-11,15,23H,12-14H2,1-2H3,(H,21,24).
What are the key properties of N'-benzyl-N'-(2-hydroxyethyl)-N-(2-propan-2-ylphenyl)oxamide?
N'-benzyl-N'-(2-hydroxyethyl)-N-(2-propan-2-ylphenyl)oxamide has a molecular weight of 340.42 g/mol, XLogP of 2.77, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-benzyl-N'-(2-hydroxyethyl)-N-(2-propan-2-ylphenyl)oxamide is sourced from PubChem (CID 108500524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).