2-(4,5-dimethoxy-2-methylanilino)-N-(3,4-dimethoxyphenyl)acetamide

C19H24N2O5 — CID 9105356

IUPAC2-(4,5-dimethoxy-2-methylanilino)-N-(3,4-dimethoxyphenyl)acetamide
SMILESCOc1ccc(NC(=O)CNc2cc(OC)c(OC)cc2C)cc1OC
InChIInChI=1S/C19H24N2O5/c1-12-8-16(24-3)18(26-5)10-14(12)20-11-19(22)21-13-6-7-15(23-2)17(9-13)25-4/h6-10,20H,11H2,1-5H3,(H,21,22)
InChIKeyVJWWHSAUOWCWED-UHFFFAOYSA-N
MW360.41 g/mol
LogP3.08
Rot. Bonds8

About 2-(4,5-dimethoxy-2-methylanilino)-N-(3,4-dimethoxyphenyl)acetamide

2-(4,5-dimethoxy-2-methylanilino)-N-(3,4-dimethoxyphenyl)acetamide (PubChem CID 9105356) has the molecular formula C19H24N2O5 and a molecular weight of 360.41 g/mol. Its IUPAC name is 2-(4,5-dimethoxy-2-methylanilino)-N-(3,4-dimethoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(4,5-dimethoxy-2-methylanilino)-N-(3,4-dimethoxyphenyl)acetamide
PubChem CID9105356
Molecular FormulaC19H24N2O5
Molecular Weight360.41 g/mol
Exact Mass360.17
IUPAC Name2-(4,5-dimethoxy-2-methylanilino)-N-(3,4-dimethoxyphenyl)acetamide
SMILESCOc1ccc(NC(=O)CNc2cc(OC)c(OC)cc2C)cc1OC
InChIInChI=1S/C19H24N2O5/c1-12-8-16(24-3)18(26-5)10-14(12)20-11-19(22)21-13-6-7-15(23-2)17(9-13)25-4/h6-10,20H,11H2,1-5H3,(H,21,22)
InChIKeyVJWWHSAUOWCWED-UHFFFAOYSA-N
XLogP3.08
TPSA78.05 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.41
LogP ≤ 53.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

N-(3,4-dimethoxyphenyl)-2-(2,4-dimethylanilino)acetamide
CID 9081068
2-(4,5-dimethoxy-2-methylanilino)-N-[4-(trifluoromethyl)phenyl]acetamide
CID 9105343
N-(3,4-dimethoxyphenyl)-2-(naphthalen-1-ylamino)acetamide
CID 9082418
N-[4-(difluoromethylsulfanyl)phenyl]-2-(4,5-dimethoxy-2-methylanilino)acetamide
CID 9105236
N,N'-bis(3,4-dimethoxyphenyl)propanediamide
CID 21232287
2-(4-bromo-3-methylanilino)-N-(3,4-dimethoxyphenyl)acetamide
CID 9099482
N-(5-chloro-2-methoxyphenyl)-2-(4,5-dimethoxy-2-methylanilino)acetamide
CID 9105369
N-(3,4-dimethoxyphenyl)-2-(4-ethylanilino)acetamide
CID 37465407
N-(3-chloro-4-methoxyphenyl)-2-(3,4-dimethoxyanilino)acetamide
CID 109008835
2-(2-chloro-4-fluoroanilino)-N-(3,4-dimethoxyphenyl)acetamide
CID 9099540
N-(3,4-difluorophenyl)-2-(3,4-dimethoxyanilino)acetamide
CID 109009628
2-(4,5-dimethoxy-2-methylanilino)-N-(2,4-dimethoxyphenyl)acetamide
CID 9105392

Frequently Asked Questions

What is the IUPAC name of 2-(4,5-dimethoxy-2-methylanilino)-N-(3,4-dimethoxyphenyl)acetamide?
The IUPAC name of 2-(4,5-dimethoxy-2-methylanilino)-N-(3,4-dimethoxyphenyl)acetamide (CID 9105356) is 2-(4,5-dimethoxy-2-methylanilino)-N-(3,4-dimethoxyphenyl)acetamide.
What is the SMILES notation for 2-(4,5-dimethoxy-2-methylanilino)-N-(3,4-dimethoxyphenyl)acetamide?
The canonical SMILES for 2-(4,5-dimethoxy-2-methylanilino)-N-(3,4-dimethoxyphenyl)acetamide is COc1ccc(NC(=O)CNc2cc(OC)c(OC)cc2C)cc1OC.
What is the InChIKey of 2-(4,5-dimethoxy-2-methylanilino)-N-(3,4-dimethoxyphenyl)acetamide?
The InChIKey is VJWWHSAUOWCWED-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O5/c1-12-8-16(24-3)18(26-5)10-14(12)20-11-19(22)21-13-6-7-15(23-2)17(9-13)25-4/h6-10,20H,11H2,1-5H3,(H,21,22).
What are the key properties of 2-(4,5-dimethoxy-2-methylanilino)-N-(3,4-dimethoxyphenyl)acetamide?
2-(4,5-dimethoxy-2-methylanilino)-N-(3,4-dimethoxyphenyl)acetamide has a molecular weight of 360.41 g/mol, XLogP of 3.08, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,5-dimethoxy-2-methylanilino)-N-(3,4-dimethoxyphenyl)acetamide is sourced from PubChem (CID 9105356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).