N-(2-ethylphenyl)-N'-(4-methoxyphenyl)-2,2-dimethylpropanediamide

C20H24N2O3 — CID 108968210

IUPACN-(2-ethylphenyl)-N'-(4-methoxyphenyl)-2,2-dimethylpropanediamide
SMILESCCc1ccccc1NC(=O)C(C)(C)C(=O)Nc1ccc(OC)cc1
InChIInChI=1S/C20H24N2O3/c1-5-14-8-6-7-9-17(14)22-19(24)20(2,3)18(23)21-15-10-12-16(25-4)13-11-15/h6-13H,5H2,1-4H3,(H,21,23)(H,22,24)
InChIKeyLMDIRPBYOWLTDX-UHFFFAOYSA-N
MW340.42 g/mol
LogP3.86
Rot. Bonds6

About N-(2-ethylphenyl)-N'-(4-methoxyphenyl)-2,2-dimethylpropanediamide

N-(2-ethylphenyl)-N'-(4-methoxyphenyl)-2,2-dimethylpropanediamide (PubChem CID 108968210) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is N-(2-ethylphenyl)-N'-(4-methoxyphenyl)-2,2-dimethylpropanediamide.

Molecular Properties

Compound NameN-(2-ethylphenyl)-N'-(4-methoxyphenyl)-2,2-dimethylpropanediamide
PubChem CID108968210
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC NameN-(2-ethylphenyl)-N'-(4-methoxyphenyl)-2,2-dimethylpropanediamide
SMILESCCc1ccccc1NC(=O)C(C)(C)C(=O)Nc1ccc(OC)cc1
InChIInChI=1S/C20H24N2O3/c1-5-14-8-6-7-9-17(14)22-19(24)20(2,3)18(23)21-15-10-12-16(25-4)13-11-15/h6-13H,5H2,1-4H3,(H,21,23)(H,22,24)
InChIKeyLMDIRPBYOWLTDX-UHFFFAOYSA-N
XLogP3.86
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 53.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(4-acetamidophenyl)-N'-(2-ethylphenyl)-2,2-dimethylpropanediamide
CID 108968225
N,N'-bis(2-ethylphenyl)-2,2-dimethylpropanediamide
CID 108968190
N-(4-chlorophenyl)-N'-(2-ethylphenyl)-2,2-dimethylpropanediamide
CID 108968199
N-(2-ethylphenyl)-N'-[2-(4-methoxyphenyl)ethyl]-2,2-dimethylpropanediamide
CID 108964450
N-(2-chlorophenyl)-N'-(4-methoxyphenyl)-2,2-dimethylpropanediamide
CID 108968862
2-(2-ethylanilino)-N-(4-methoxyphenyl)acetamide
CID 26439643
1-N-(2-ethylphenyl)-2-N-(4-methoxyphenyl)cyclopropane-1,2-dicarboxamide
CID 109142010
N-[4-(dimethylamino)phenyl]-N'-(4-methoxyphenyl)-2,2-dimethylpropanediamide
CID 108969421
2-[ethyl-[2-(2-ethylanilino)-2-oxoethyl]amino]-N-(4-methoxyphenyl)acetamide
CID 9027158
N-(2,5-dimethoxyphenyl)-N'-(4-methoxyphenyl)-2,2-dimethylpropanediamide
CID 108969408
N-(3-chlorophenyl)-N'-(2-ethylphenyl)-2,2-dimethylpropanediamide
CID 108968198
2-(4-bromophenoxy)-N-(2-ethylphenyl)-2-methylpropanamide
CID 17162562

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylphenyl)-N'-(4-methoxyphenyl)-2,2-dimethylpropanediamide?
The IUPAC name of N-(2-ethylphenyl)-N'-(4-methoxyphenyl)-2,2-dimethylpropanediamide (CID 108968210) is N-(2-ethylphenyl)-N'-(4-methoxyphenyl)-2,2-dimethylpropanediamide.
What is the SMILES notation for N-(2-ethylphenyl)-N'-(4-methoxyphenyl)-2,2-dimethylpropanediamide?
The canonical SMILES for N-(2-ethylphenyl)-N'-(4-methoxyphenyl)-2,2-dimethylpropanediamide is CCc1ccccc1NC(=O)C(C)(C)C(=O)Nc1ccc(OC)cc1.
What is the InChIKey of N-(2-ethylphenyl)-N'-(4-methoxyphenyl)-2,2-dimethylpropanediamide?
The InChIKey is LMDIRPBYOWLTDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3/c1-5-14-8-6-7-9-17(14)22-19(24)20(2,3)18(23)21-15-10-12-16(25-4)13-11-15/h6-13H,5H2,1-4H3,(H,21,23)(H,22,24).
What are the key properties of N-(2-ethylphenyl)-N'-(4-methoxyphenyl)-2,2-dimethylpropanediamide?
N-(2-ethylphenyl)-N'-(4-methoxyphenyl)-2,2-dimethylpropanediamide has a molecular weight of 340.42 g/mol, XLogP of 3.86, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylphenyl)-N'-(4-methoxyphenyl)-2,2-dimethylpropanediamide is sourced from PubChem (CID 108968210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).