N'-tert-butyl-N-(2,6-dimethylphenyl)-N'-ethyloxamide

C16H24N2O2 — CID 108531366

IUPACN'-tert-butyl-N-(2,6-dimethylphenyl)-N'-ethyloxamide
SMILESCCN(C(=O)C(=O)Nc1c(C)cccc1C)C(C)(C)C
InChIInChI=1S/C16H24N2O2/c1-7-18(16(4,5)6)15(20)14(19)17-13-11(2)9-8-10-12(13)3/h8-10H,7H2,1-6H3,(H,17,19)
InChIKeyULFIQEXGMNCPDG-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.89
Rot. Bonds2

About N'-tert-butyl-N-(2,6-dimethylphenyl)-N'-ethyloxamide

N'-tert-butyl-N-(2,6-dimethylphenyl)-N'-ethyloxamide (PubChem CID 108531366) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N'-tert-butyl-N-(2,6-dimethylphenyl)-N'-ethyloxamide.

Molecular Properties

Compound NameN'-tert-butyl-N-(2,6-dimethylphenyl)-N'-ethyloxamide
PubChem CID108531366
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN'-tert-butyl-N-(2,6-dimethylphenyl)-N'-ethyloxamide
SMILESCCN(C(=O)C(=O)Nc1c(C)cccc1C)C(C)(C)C
InChIInChI=1S/C16H24N2O2/c1-7-18(16(4,5)6)15(20)14(19)17-13-11(2)9-8-10-12(13)3/h8-10H,7H2,1-6H3,(H,17,19)
InChIKeyULFIQEXGMNCPDG-UHFFFAOYSA-N
XLogP2.89
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N,N'-bis(2,6-dimethylphenyl)oxamide
CID 3764178
N-(2,6-dimethylphenyl)-N'-ethyl-N'-(3-methylphenyl)oxamide
CID 108532413
N',N'-dibenzyl-N-(2,6-dimethylphenyl)oxamide
CID 108523708
N-[4-(diethylamino)phenyl]-N'-(2,6-dimethylphenyl)-2,2-dimethylpropanediamide
CID 108968103
N,N'-bis(2-ethyl-6-methylphenyl)oxamide
CID 3725747
N'-tert-butyl-N-(5-chloro-2-hydroxyphenyl)-N'-ethyloxamide
CID 108519777
N-(2-ethyl-6-methylphenyl)-N',N'-dipropyloxamide
CID 108512105
N,3-bis(2,6-dimethylphenyl)-2-oxopropanamide
CID 158625322
bis(2-(diethylamino)-N-(2,6-dimethylphenyl)acetamide);dihydrochloride
CID 69335483
CID 89442401
CID 89442401
N-(2,6-dimethylphenyl)-2-[ethyl-(2-hydroxy-2-methylpropyl)amino]acetamide
CID 78963573
N-(2,6-dimethylphenyl)-N'-(4-hydroxyphenyl)-N'-methyloxamide
CID 108528473

Frequently Asked Questions

What is the IUPAC name of N'-tert-butyl-N-(2,6-dimethylphenyl)-N'-ethyloxamide?
The IUPAC name of N'-tert-butyl-N-(2,6-dimethylphenyl)-N'-ethyloxamide (CID 108531366) is N'-tert-butyl-N-(2,6-dimethylphenyl)-N'-ethyloxamide.
What is the SMILES notation for N'-tert-butyl-N-(2,6-dimethylphenyl)-N'-ethyloxamide?
The canonical SMILES for N'-tert-butyl-N-(2,6-dimethylphenyl)-N'-ethyloxamide is CCN(C(=O)C(=O)Nc1c(C)cccc1C)C(C)(C)C.
What is the InChIKey of N'-tert-butyl-N-(2,6-dimethylphenyl)-N'-ethyloxamide?
The InChIKey is ULFIQEXGMNCPDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-7-18(16(4,5)6)15(20)14(19)17-13-11(2)9-8-10-12(13)3/h8-10H,7H2,1-6H3,(H,17,19).
What are the key properties of N'-tert-butyl-N-(2,6-dimethylphenyl)-N'-ethyloxamide?
N'-tert-butyl-N-(2,6-dimethylphenyl)-N'-ethyloxamide has a molecular weight of 276.38 g/mol, XLogP of 2.89, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-tert-butyl-N-(2,6-dimethylphenyl)-N'-ethyloxamide is sourced from PubChem (CID 108531366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).