N'-ethyl-N'-(2-methylphenyl)-N-propan-2-yloxamide

C14H20N2O2 — CID 47332754

IUPACN'-ethyl-N'-(2-methylphenyl)-N-propan-2-yloxamide
SMILESCCN(C(=O)C(=O)NC(C)C)c1ccccc1C
InChIInChI=1S/C14H20N2O2/c1-5-16(12-9-7-6-8-11(12)4)14(18)13(17)15-10(2)3/h6-10H,5H2,1-4H3,(H,15,17)
InChIKeyZBZRDQHNKCVMAL-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.87
Rot. Bonds3

About N'-ethyl-N'-(2-methylphenyl)-N-propan-2-yloxamide

N'-ethyl-N'-(2-methylphenyl)-N-propan-2-yloxamide (PubChem CID 47332754) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is N'-ethyl-N'-(2-methylphenyl)-N-propan-2-yloxamide.

Molecular Properties

Compound NameN'-ethyl-N'-(2-methylphenyl)-N-propan-2-yloxamide
PubChem CID47332754
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC NameN'-ethyl-N'-(2-methylphenyl)-N-propan-2-yloxamide
SMILESCCN(C(=O)C(=O)NC(C)C)c1ccccc1C
InChIInChI=1S/C14H20N2O2/c1-5-16(12-9-7-6-8-11(12)4)14(18)13(17)15-10(2)3/h6-10H,5H2,1-4H3,(H,15,17)
InChIKeyZBZRDQHNKCVMAL-UHFFFAOYSA-N
XLogP1.87
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.87
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

3-(N-ethyl-2-methylanilino)-2-methyl-3-oxopropanoic acid
CID 114896860
N-ethyl-2-methyl-3-(methylamino)-N-(2-methylphenyl)propanamide
CID 79196148
N-ethyl-2,2-difluoro-N-(2-methylphenyl)acetamide
CID 103515266
2,2-dichloro-N-ethyl-N-(2-methylphenyl)acetamide
CID 3338024
N-ethyl-2-methyl-N-(2-methylphenyl)pentanamide
CID 2890658
2-[[2-(N-ethyl-2-methylanilino)-2-oxoethyl]amino]propanoic acid
CID 43467078
2-(N-ethyl-2-methylanilino)-N-(propan-2-ylcarbamoyl)acetamide
CID 47121669
(2R)-2-[[ethyl-(2-methylphenyl)carbamoyl]amino]-3-hydroxypropanoic acid
CID 80749854
N,N'-diethyl-N,N'-bis(2-methylphenyl)-2-phenylpropanediamide
CID 3396233
3-[[2-(N-ethyl-2-methylanilino)-2-oxoethyl]-methylamino]propanoic acid
CID 60987713
N-ethyl-2-[3-hydroxypropyl(propan-2-yl)amino]-N-(2-methylphenyl)acetamide
CID 62014625
methyl 2-(N-acetyl-2-methylanilino)acetate
CID 20717630

Frequently Asked Questions

What is the IUPAC name of N'-ethyl-N'-(2-methylphenyl)-N-propan-2-yloxamide?
The IUPAC name of N'-ethyl-N'-(2-methylphenyl)-N-propan-2-yloxamide (CID 47332754) is N'-ethyl-N'-(2-methylphenyl)-N-propan-2-yloxamide.
What is the SMILES notation for N'-ethyl-N'-(2-methylphenyl)-N-propan-2-yloxamide?
The canonical SMILES for N'-ethyl-N'-(2-methylphenyl)-N-propan-2-yloxamide is CCN(C(=O)C(=O)NC(C)C)c1ccccc1C.
What is the InChIKey of N'-ethyl-N'-(2-methylphenyl)-N-propan-2-yloxamide?
The InChIKey is ZBZRDQHNKCVMAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-5-16(12-9-7-6-8-11(12)4)14(18)13(17)15-10(2)3/h6-10H,5H2,1-4H3,(H,15,17).
What are the key properties of N'-ethyl-N'-(2-methylphenyl)-N-propan-2-yloxamide?
N'-ethyl-N'-(2-methylphenyl)-N-propan-2-yloxamide has a molecular weight of 248.33 g/mol, XLogP of 1.87, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethyl-N'-(2-methylphenyl)-N-propan-2-yloxamide is sourced from PubChem (CID 47332754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).