N-ethyl-2-(N-ethyl-2-methylanilino)-N-(2-methylprop-2-enyl)acetamide

C17H26N2O — CID 78820883

IUPACN-ethyl-2-(N-ethyl-2-methylanilino)-N-(2-methylprop-2-enyl)acetamide
SMILESC=C(C)CN(CC)C(=O)CN(CC)c1ccccc1C
InChIInChI=1S/C17H26N2O/c1-6-18(16-11-9-8-10-15(16)5)13-17(20)19(7-2)12-14(3)4/h8-11H,3,6-7,12-13H2,1-2,4-5H3
InChIKeyLSGCFKIMDUQTIW-UHFFFAOYSA-N
MW274.41 g/mol
LogP3.25
Rot. Bonds7

About N-ethyl-2-(N-ethyl-2-methylanilino)-N-(2-methylprop-2-enyl)acetamide

N-ethyl-2-(N-ethyl-2-methylanilino)-N-(2-methylprop-2-enyl)acetamide (PubChem CID 78820883) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is N-ethyl-2-(N-ethyl-2-methylanilino)-N-(2-methylprop-2-enyl)acetamide.

Molecular Properties

Compound NameN-ethyl-2-(N-ethyl-2-methylanilino)-N-(2-methylprop-2-enyl)acetamide
PubChem CID78820883
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC NameN-ethyl-2-(N-ethyl-2-methylanilino)-N-(2-methylprop-2-enyl)acetamide
SMILESC=C(C)CN(CC)C(=O)CN(CC)c1ccccc1C
InChIInChI=1S/C17H26N2O/c1-6-18(16-11-9-8-10-15(16)5)13-17(20)19(7-2)12-14(3)4/h8-11H,3,6-7,12-13H2,1-2,4-5H3
InChIKeyLSGCFKIMDUQTIW-UHFFFAOYSA-N
XLogP3.25
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 53.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N'-ethyl-2-methylidene-N'-(2-methylphenyl)propane-1,3-diamine
CID 103069098
4-(N-ethyl-2-methylanilino)butan-2-one
CID 28948801
N-(2,6-dimethylphenyl)-2-[[2-[ethyl(2-methylprop-2-enyl)amino]-2-oxoethyl]-methylamino]acetamide
CID 8793567
2-(N-ethyl-2-methylanilino)-1-(4-iodophenyl)ethanone
CID 43228314
2-(2-aminophenyl)-N-ethyl-N-(2-methylprop-2-enyl)acetamide
CID 61118628
N-ethyl-N-(2-methylprop-2-enyl)-2-phenylsulfanylacetamide
CID 78762330
2-[benzenesulfonyl(methyl)amino]-N-ethyl-N-(2-methylprop-2-enyl)acetamide
CID 78767125
2-(N-ethyl-2-methylanilino)-N-(propan-2-ylcarbamoyl)acetamide
CID 47121669
2-(N-ethyl-2-methylanilino)-N-(2-iodophenyl)acetamide
CID 55434677
1-(2,5-dimethylthiophen-3-yl)-2-(N-ethyl-2-methylanilino)ethanone
CID 43228322
2-(N-ethyl-2-methylanilino)-1-(1-methylpyrrol-2-yl)ethanone
CID 43228316
1-(3-bromothiophen-2-yl)-2-(N-ethyl-2-methylanilino)ethanone
CID 43794167

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(N-ethyl-2-methylanilino)-N-(2-methylprop-2-enyl)acetamide?
The IUPAC name of N-ethyl-2-(N-ethyl-2-methylanilino)-N-(2-methylprop-2-enyl)acetamide (CID 78820883) is N-ethyl-2-(N-ethyl-2-methylanilino)-N-(2-methylprop-2-enyl)acetamide.
What is the SMILES notation for N-ethyl-2-(N-ethyl-2-methylanilino)-N-(2-methylprop-2-enyl)acetamide?
The canonical SMILES for N-ethyl-2-(N-ethyl-2-methylanilino)-N-(2-methylprop-2-enyl)acetamide is C=C(C)CN(CC)C(=O)CN(CC)c1ccccc1C.
What is the InChIKey of N-ethyl-2-(N-ethyl-2-methylanilino)-N-(2-methylprop-2-enyl)acetamide?
The InChIKey is LSGCFKIMDUQTIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-6-18(16-11-9-8-10-15(16)5)13-17(20)19(7-2)12-14(3)4/h8-11H,3,6-7,12-13H2,1-2,4-5H3.
What are the key properties of N-ethyl-2-(N-ethyl-2-methylanilino)-N-(2-methylprop-2-enyl)acetamide?
N-ethyl-2-(N-ethyl-2-methylanilino)-N-(2-methylprop-2-enyl)acetamide has a molecular weight of 274.41 g/mol, XLogP of 3.25, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(N-ethyl-2-methylanilino)-N-(2-methylprop-2-enyl)acetamide is sourced from PubChem (CID 78820883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).