2-(4-ethoxyanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide

C20H26N2O2 — CID 109008142

IUPAC2-(4-ethoxyanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
SMILESCCOc1ccc(NCC(=O)Nc2c(C)cccc2C(C)C)cc1
InChIInChI=1S/C20H26N2O2/c1-5-24-17-11-9-16(10-12-17)21-13-19(23)22-20-15(4)7-6-8-18(20)14(2)3/h6-12,14,21H,5,13H2,1-4H3,(H,22,23)
InChIKeyQASQHUDCPQHFTE-UHFFFAOYSA-N
MW326.44 g/mol
LogP4.57
Rot. Bonds7

About 2-(4-ethoxyanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide

2-(4-ethoxyanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide (PubChem CID 109008142) has the molecular formula C20H26N2O2 and a molecular weight of 326.44 g/mol. Its IUPAC name is 2-(4-ethoxyanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(4-ethoxyanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
PubChem CID109008142
Molecular FormulaC20H26N2O2
Molecular Weight326.44 g/mol
Exact Mass326.20
IUPAC Name2-(4-ethoxyanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
SMILESCCOc1ccc(NCC(=O)Nc2c(C)cccc2C(C)C)cc1
InChIInChI=1S/C20H26N2O2/c1-5-24-17-11-9-16(10-12-17)21-13-19(23)22-20-15(4)7-6-8-18(20)14(2)3/h6-12,14,21H,5,13H2,1-4H3,(H,22,23)
InChIKeyQASQHUDCPQHFTE-UHFFFAOYSA-N
XLogP4.57
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 54.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

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Related Compounds

2-(4-ethoxyphenyl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 51536149
2-(4-acetylanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 109008153
4-ethoxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide
CID 2701404
2-(2-ethoxyanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 109008141
1-(4-ethoxyphenyl)-3-(2-methyl-6-propan-2-ylphenyl)thiourea
CID 17264833
N-(2,6-dimethylphenyl)-2-[4-(2-ethoxyethoxy)anilino]acetamide
CID 54825290
2-(4-ethoxyanilino)-N-(4-propan-2-ylphenyl)acetamide
CID 39452982
2-(4-methoxyphenoxy)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 7688543
3-[(4-ethoxyphenyl)sulfonylamino]-N-(2-methyl-6-propan-2-ylphenyl)propanamide
CID 112789058
N-(4-ethoxyphenyl)-2-(3-propan-2-yloxyanilino)acetamide
CID 54830003
N-(2-methyl-6-propan-2-ylphenyl)-2-(4-phenylphenoxy)acetamide
CID 7790431
4-(4-tert-butylphenoxy)-N-(2-methyl-6-propan-2-ylphenyl)butanamide
CID 7790411

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethoxyanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide?
The IUPAC name of 2-(4-ethoxyanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide (CID 109008142) is 2-(4-ethoxyanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide.
What is the SMILES notation for 2-(4-ethoxyanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide?
The canonical SMILES for 2-(4-ethoxyanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide is CCOc1ccc(NCC(=O)Nc2c(C)cccc2C(C)C)cc1.
What is the InChIKey of 2-(4-ethoxyanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide?
The InChIKey is QASQHUDCPQHFTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O2/c1-5-24-17-11-9-16(10-12-17)21-13-19(23)22-20-15(4)7-6-8-18(20)14(2)3/h6-12,14,21H,5,13H2,1-4H3,(H,22,23).
What are the key properties of 2-(4-ethoxyanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide?
2-(4-ethoxyanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide has a molecular weight of 326.44 g/mol, XLogP of 4.57, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethoxyanilino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide is sourced from PubChem (CID 109008142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).