N-(3,4-dimethoxyphenyl)-N'-(2-methoxyphenyl)-2,2-dimethylpropanediamide

C20H24N2O5 — CID 108969309

IUPACN-(3,4-dimethoxyphenyl)-N'-(2-methoxyphenyl)-2,2-dimethylpropanediamide
SMILESCOc1ccccc1NC(=O)C(C)(C)C(=O)Nc1ccc(OC)c(OC)c1
InChIInChI=1S/C20H24N2O5/c1-20(2,19(24)22-14-8-6-7-9-15(14)25-3)18(23)21-13-10-11-16(26-4)17(12-13)27-5/h6-12H,1-5H3,(H,21,23)(H,22,24)
InChIKeyPLXREYJGPXESKZ-UHFFFAOYSA-N
MW372.42 g/mol
LogP3.32
Rot. Bonds7

About N-(3,4-dimethoxyphenyl)-N'-(2-methoxyphenyl)-2,2-dimethylpropanediamide

N-(3,4-dimethoxyphenyl)-N'-(2-methoxyphenyl)-2,2-dimethylpropanediamide (PubChem CID 108969309) has the molecular formula C20H24N2O5 and a molecular weight of 372.42 g/mol. Its IUPAC name is N-(3,4-dimethoxyphenyl)-N'-(2-methoxyphenyl)-2,2-dimethylpropanediamide.

Molecular Properties

Compound NameN-(3,4-dimethoxyphenyl)-N'-(2-methoxyphenyl)-2,2-dimethylpropanediamide
PubChem CID108969309
Molecular FormulaC20H24N2O5
Molecular Weight372.42 g/mol
Exact Mass372.17
IUPAC NameN-(3,4-dimethoxyphenyl)-N'-(2-methoxyphenyl)-2,2-dimethylpropanediamide
SMILESCOc1ccccc1NC(=O)C(C)(C)C(=O)Nc1ccc(OC)c(OC)c1
InChIInChI=1S/C20H24N2O5/c1-20(2,19(24)22-14-8-6-7-9-15(14)25-3)18(23)21-13-10-11-16(26-4)17(12-13)27-5/h6-12H,1-5H3,(H,21,23)(H,22,24)
InChIKeyPLXREYJGPXESKZ-UHFFFAOYSA-N
XLogP3.32
TPSA85.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.42
LogP ≤ 53.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Related Compounds

N-(2-cyanophenyl)-N'-(3,4-dimethoxyphenyl)-2,2-dimethylpropanediamide
CID 108969671
N-(4-acetamidophenyl)-N'-(3,4-dimethoxyphenyl)-2,2-dimethylpropanediamide
CID 108969664
methyl 3-[[3-(2-methoxyanilino)-2,2-dimethyl-3-oxopropanoyl]amino]benzoate
CID 108969318
N-(3-chloro-4-methoxyphenyl)-N'-(2-ethoxyphenyl)-2,2-dimethylpropanediamide
CID 108969247
N-(3,4-dimethoxyphenyl)-2-(2-methoxyphenyl)-2-methylpropanamide
CID 110438838
N-(3,4-dimethoxyphenyl)-2,2-dimethyl-N'-(2-phenylethyl)propanediamide
CID 108963883
N-(2-methoxyphenyl)-2,2-dimethyl-N'-(4-piperidin-1-ylphenyl)propanediamide
CID 108969323
N-(2,5-dimethoxyphenyl)-N'-(4-methoxyphenyl)-2,2-dimethylpropanediamide
CID 108969408
N-(3,4-dimethoxyphenyl)-N'-(4-ethoxyphenyl)-2,2-dimethylpropanediamide
CID 108969501
2-hydroxy-N-(2-methoxyphenyl)-2-methylpropanamide
CID 22287395
N-(2-methoxy-5-methylphenyl)-2,2-dimethyl-N'-(2-propan-2-yloxyphenyl)propanediamide
CID 108969538
N-(3-chloro-4-methoxyphenyl)-N'-(2-cyanophenyl)-2,2-dimethylpropanediamide
CID 108969258

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethoxyphenyl)-N'-(2-methoxyphenyl)-2,2-dimethylpropanediamide?
The IUPAC name of N-(3,4-dimethoxyphenyl)-N'-(2-methoxyphenyl)-2,2-dimethylpropanediamide (CID 108969309) is N-(3,4-dimethoxyphenyl)-N'-(2-methoxyphenyl)-2,2-dimethylpropanediamide.
What is the SMILES notation for N-(3,4-dimethoxyphenyl)-N'-(2-methoxyphenyl)-2,2-dimethylpropanediamide?
The canonical SMILES for N-(3,4-dimethoxyphenyl)-N'-(2-methoxyphenyl)-2,2-dimethylpropanediamide is COc1ccccc1NC(=O)C(C)(C)C(=O)Nc1ccc(OC)c(OC)c1.
What is the InChIKey of N-(3,4-dimethoxyphenyl)-N'-(2-methoxyphenyl)-2,2-dimethylpropanediamide?
The InChIKey is PLXREYJGPXESKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O5/c1-20(2,19(24)22-14-8-6-7-9-15(14)25-3)18(23)21-13-10-11-16(26-4)17(12-13)27-5/h6-12H,1-5H3,(H,21,23)(H,22,24).
What are the key properties of N-(3,4-dimethoxyphenyl)-N'-(2-methoxyphenyl)-2,2-dimethylpropanediamide?
N-(3,4-dimethoxyphenyl)-N'-(2-methoxyphenyl)-2,2-dimethylpropanediamide has a molecular weight of 372.42 g/mol, XLogP of 3.32, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethoxyphenyl)-N'-(2-methoxyphenyl)-2,2-dimethylpropanediamide is sourced from PubChem (CID 108969309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).