2-(3-amino-N-ethylanilino)-N-(4-methylphenyl)acetamide

C17H21N3O — CID 63229853

IUPAC2-(3-amino-N-ethylanilino)-N-(4-methylphenyl)acetamide
SMILESCCN(CC(=O)Nc1ccc(C)cc1)c1cccc(N)c1
InChIInChI=1S/C17H21N3O/c1-3-20(16-6-4-5-14(18)11-16)12-17(21)19-15-9-7-13(2)8-10-15/h4-11H,3,12,18H2,1-2H3,(H,19,21)
InChIKeyJUUCJAXCANAPBQ-UHFFFAOYSA-N
MW283.38 g/mol
LogP3.04
Rot. Bonds5

About 2-(3-amino-N-ethylanilino)-N-(4-methylphenyl)acetamide

2-(3-amino-N-ethylanilino)-N-(4-methylphenyl)acetamide (PubChem CID 63229853) has the molecular formula C17H21N3O and a molecular weight of 283.38 g/mol. Its IUPAC name is 2-(3-amino-N-ethylanilino)-N-(4-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(3-amino-N-ethylanilino)-N-(4-methylphenyl)acetamide
PubChem CID63229853
Molecular FormulaC17H21N3O
Molecular Weight283.38 g/mol
Exact Mass283.17
IUPAC Name2-(3-amino-N-ethylanilino)-N-(4-methylphenyl)acetamide
SMILESCCN(CC(=O)Nc1ccc(C)cc1)c1cccc(N)c1
InChIInChI=1S/C17H21N3O/c1-3-20(16-6-4-5-14(18)11-16)12-17(21)19-15-9-7-13(2)8-10-15/h4-11H,3,12,18H2,1-2H3,(H,19,21)
InChIKeyJUUCJAXCANAPBQ-UHFFFAOYSA-N
XLogP3.04
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.38
LogP ≤ 53.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(N-ethyl-3-fluoroanilino)-N-(4-methylphenyl)acetamide
CID 60517438
N-(3-aminophenyl)-2-(N-ethylanilino)acetamide
CID 16790236
2-(3-amino-N-ethylanilino)-N-(3-chlorophenyl)acetamide
CID 63229764
N-(4-aminophenyl)-2-(N-ethyl-3-hydroxyanilino)acetamide
CID 107733928
2-(3-amino-N-ethylanilino)-N-(2-methylphenyl)acetamide
CID 63229896
2-(4-amino-N-ethylanilino)-N-(3-methylphenyl)acetamide
CID 63233755
2-(4-methyl-N-[2-(4-methylanilino)-2-oxoethyl]anilino)-N-(4-methylphenyl)acetamide
CID 2645683
2-(3-amino-N-methylanilino)-N-(4-fluorophenyl)acetamide
CID 61297875
2-(3-aminophenyl)-N-[4-(diethylamino)phenyl]acetamide
CID 28712277
N-(3-chlorophenyl)-2-(N-ethyl-3-methylanilino)acetamide
CID 109008467
2-(3-amino-N-ethylanilino)-N-cyclopentylacetamide
CID 55175748
2-(N-benzylanilino)-N-(4-methylphenyl)acetamide
CID 109007221

Frequently Asked Questions

What is the IUPAC name of 2-(3-amino-N-ethylanilino)-N-(4-methylphenyl)acetamide?
The IUPAC name of 2-(3-amino-N-ethylanilino)-N-(4-methylphenyl)acetamide (CID 63229853) is 2-(3-amino-N-ethylanilino)-N-(4-methylphenyl)acetamide.
What is the SMILES notation for 2-(3-amino-N-ethylanilino)-N-(4-methylphenyl)acetamide?
The canonical SMILES for 2-(3-amino-N-ethylanilino)-N-(4-methylphenyl)acetamide is CCN(CC(=O)Nc1ccc(C)cc1)c1cccc(N)c1.
What is the InChIKey of 2-(3-amino-N-ethylanilino)-N-(4-methylphenyl)acetamide?
The InChIKey is JUUCJAXCANAPBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O/c1-3-20(16-6-4-5-14(18)11-16)12-17(21)19-15-9-7-13(2)8-10-15/h4-11H,3,12,18H2,1-2H3,(H,19,21).
What are the key properties of 2-(3-amino-N-ethylanilino)-N-(4-methylphenyl)acetamide?
2-(3-amino-N-ethylanilino)-N-(4-methylphenyl)acetamide has a molecular weight of 283.38 g/mol, XLogP of 3.04, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-amino-N-ethylanilino)-N-(4-methylphenyl)acetamide is sourced from PubChem (CID 63229853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).