N-(2,6-diethylphenyl)-N'-(1-hydroxy-2-methylpropan-2-yl)oxamide

C16H24N2O3 — CID 108511574

IUPACN-(2,6-diethylphenyl)-N'-(1-hydroxy-2-methylpropan-2-yl)oxamide
SMILESCCc1cccc(CC)c1NC(=O)C(=O)NC(C)(C)CO
InChIInChI=1S/C16H24N2O3/c1-5-11-8-7-9-12(6-2)13(11)17-14(20)15(21)18-16(3,4)10-19/h7-9,19H,5-6,10H2,1-4H3,(H,17,20)(H,18,21)
InChIKeyJZQFSZQCZORKOA-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.64
Rot. Bonds5

About N-(2,6-diethylphenyl)-N'-(1-hydroxy-2-methylpropan-2-yl)oxamide

N-(2,6-diethylphenyl)-N'-(1-hydroxy-2-methylpropan-2-yl)oxamide (PubChem CID 108511574) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is N-(2,6-diethylphenyl)-N'-(1-hydroxy-2-methylpropan-2-yl)oxamide.

Molecular Properties

Compound NameN-(2,6-diethylphenyl)-N'-(1-hydroxy-2-methylpropan-2-yl)oxamide
PubChem CID108511574
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC NameN-(2,6-diethylphenyl)-N'-(1-hydroxy-2-methylpropan-2-yl)oxamide
SMILESCCc1cccc(CC)c1NC(=O)C(=O)NC(C)(C)CO
InChIInChI=1S/C16H24N2O3/c1-5-11-8-7-9-12(6-2)13(11)17-14(20)15(21)18-16(3,4)10-19/h7-9,19H,5-6,10H2,1-4H3,(H,17,20)(H,18,21)
InChIKeyJZQFSZQCZORKOA-UHFFFAOYSA-N
XLogP1.64
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.64
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

N,N'-bis(2-ethyl-6-methylphenyl)oxamide
CID 3725747
N'-(1-hydroxy-2-methylpropan-2-yl)-N-(3-methylphenyl)oxamide
CID 44996302
3-[(2,6-diethylphenyl)carbamoylamino]-3-methylbutanoic acid
CID 64701407
N-(2-tert-butylphenyl)-N'-(1-hydroxy-2-methylpropan-2-yl)oxamide
CID 108530240
N-(2,6-diethylphenyl)-N'-(1,3-thiazol-2-yl)oxamide
CID 108511411
N-(2-chlorophenyl)-N'-(1-hydroxy-2-methylpropan-2-yl)oxamide
CID 45000720
N-(cyanomethyl)-N'-(2,6-diethylphenyl)oxamide
CID 43315674
N-(2-chloroethyl)-N'-(2,6-diethylphenyl)oxamide
CID 108511372
N'-(1-hydroxy-2-methylpropan-2-yl)-N-(3-methoxyphenyl)oxamide
CID 44999402
N'-(2,6-diethylphenyl)-N-(3-hydroxy-2-methylpropyl)oxamide
CID 47669792
N'-(2,6-diethylphenyl)-N-(2,3-dimethylphenyl)oxamide
CID 108511380
N-(4-acetylphenyl)-N'-(2,6-diethylphenyl)oxamide
CID 108511377

Frequently Asked Questions

What is the IUPAC name of N-(2,6-diethylphenyl)-N'-(1-hydroxy-2-methylpropan-2-yl)oxamide?
The IUPAC name of N-(2,6-diethylphenyl)-N'-(1-hydroxy-2-methylpropan-2-yl)oxamide (CID 108511574) is N-(2,6-diethylphenyl)-N'-(1-hydroxy-2-methylpropan-2-yl)oxamide.
What is the SMILES notation for N-(2,6-diethylphenyl)-N'-(1-hydroxy-2-methylpropan-2-yl)oxamide?
The canonical SMILES for N-(2,6-diethylphenyl)-N'-(1-hydroxy-2-methylpropan-2-yl)oxamide is CCc1cccc(CC)c1NC(=O)C(=O)NC(C)(C)CO.
What is the InChIKey of N-(2,6-diethylphenyl)-N'-(1-hydroxy-2-methylpropan-2-yl)oxamide?
The InChIKey is JZQFSZQCZORKOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-5-11-8-7-9-12(6-2)13(11)17-14(20)15(21)18-16(3,4)10-19/h7-9,19H,5-6,10H2,1-4H3,(H,17,20)(H,18,21).
What are the key properties of N-(2,6-diethylphenyl)-N'-(1-hydroxy-2-methylpropan-2-yl)oxamide?
N-(2,6-diethylphenyl)-N'-(1-hydroxy-2-methylpropan-2-yl)oxamide has a molecular weight of 292.38 g/mol, XLogP of 1.64, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-diethylphenyl)-N'-(1-hydroxy-2-methylpropan-2-yl)oxamide is sourced from PubChem (CID 108511574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).