2-(2-ethyl-6-methylanilino)-N-(3-propoxyphenyl)acetamide

C20H26N2O2 — CID 54819274

IUPAC2-(2-ethyl-6-methylanilino)-N-(3-propoxyphenyl)acetamide
SMILESCCCOc1cccc(NC(=O)CNc2c(C)cccc2CC)c1
InChIInChI=1S/C20H26N2O2/c1-4-12-24-18-11-7-10-17(13-18)22-19(23)14-21-20-15(3)8-6-9-16(20)5-2/h6-11,13,21H,4-5,12,14H2,1-3H3,(H,22,23)
InChIKeyZBZHTMDZHPHORI-UHFFFAOYSA-N
MW326.44 g/mol
LogP4.40
Rot. Bonds8

About 2-(2-ethyl-6-methylanilino)-N-(3-propoxyphenyl)acetamide

2-(2-ethyl-6-methylanilino)-N-(3-propoxyphenyl)acetamide (PubChem CID 54819274) has the molecular formula C20H26N2O2 and a molecular weight of 326.44 g/mol. Its IUPAC name is 2-(2-ethyl-6-methylanilino)-N-(3-propoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(2-ethyl-6-methylanilino)-N-(3-propoxyphenyl)acetamide
PubChem CID54819274
Molecular FormulaC20H26N2O2
Molecular Weight326.44 g/mol
Exact Mass326.20
IUPAC Name2-(2-ethyl-6-methylanilino)-N-(3-propoxyphenyl)acetamide
SMILESCCCOc1cccc(NC(=O)CNc2c(C)cccc2CC)c1
InChIInChI=1S/C20H26N2O2/c1-4-12-24-18-11-7-10-17(13-18)22-19(23)14-21-20-15(3)8-6-9-16(20)5-2/h6-11,13,21H,4-5,12,14H2,1-3H3,(H,22,23)
InChIKeyZBZHTMDZHPHORI-UHFFFAOYSA-N
XLogP4.40
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 54.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-ethyl-6-methylanilino)-N-[3-(2-methylprop-2-enoxy)phenyl]acetamide
CID 54819355
2-(2,6-dimethylanilino)-N-(3-hexoxyphenyl)acetamide
CID 54818482
N-(3-acetamidophenyl)-2-(2-ethyl-6-methylanilino)acetamide
CID 54819356
N-[3-[[2-(3-propoxyanilino)acetyl]amino]phenyl]propanamide
CID 54825188
2-(4-butoxyanilino)-N-(3-propoxyphenyl)acetamide
CID 54820125
2-(ethylamino)-N-(3-propoxyphenyl)acetamide
CID 54820704
N-(3,4-dimethylphenyl)-2-(2-ethyl-6-methylanilino)acetamide
CID 33004358
N-(4-methylphenyl)-2-(3-propoxyanilino)acetamide
CID 36860720
2-(3-chloro-4-methylanilino)-N-(3-propoxyphenyl)acetamide
CID 54815945
N-(3-prop-2-enoxyphenyl)-2-(3-propoxyanilino)acetamide
CID 54824851
N-[3-(2-methoxyethoxy)phenyl]-2-(4-propoxyanilino)acetamide
CID 54820051
N-(2-ethyl-6-methylphenyl)-2-[3-(2-methylpropoxy)anilino]acetamide
CID 54823992

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethyl-6-methylanilino)-N-(3-propoxyphenyl)acetamide?
The IUPAC name of 2-(2-ethyl-6-methylanilino)-N-(3-propoxyphenyl)acetamide (CID 54819274) is 2-(2-ethyl-6-methylanilino)-N-(3-propoxyphenyl)acetamide.
What is the SMILES notation for 2-(2-ethyl-6-methylanilino)-N-(3-propoxyphenyl)acetamide?
The canonical SMILES for 2-(2-ethyl-6-methylanilino)-N-(3-propoxyphenyl)acetamide is CCCOc1cccc(NC(=O)CNc2c(C)cccc2CC)c1.
What is the InChIKey of 2-(2-ethyl-6-methylanilino)-N-(3-propoxyphenyl)acetamide?
The InChIKey is ZBZHTMDZHPHORI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O2/c1-4-12-24-18-11-7-10-17(13-18)22-19(23)14-21-20-15(3)8-6-9-16(20)5-2/h6-11,13,21H,4-5,12,14H2,1-3H3,(H,22,23).
What are the key properties of 2-(2-ethyl-6-methylanilino)-N-(3-propoxyphenyl)acetamide?
2-(2-ethyl-6-methylanilino)-N-(3-propoxyphenyl)acetamide has a molecular weight of 326.44 g/mol, XLogP of 4.40, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethyl-6-methylanilino)-N-(3-propoxyphenyl)acetamide is sourced from PubChem (CID 54819274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).