N-(2-methoxyphenyl)-N'-(2-propan-2-yloxyphenyl)propanediamide

C19H22N2O4 — CID 108955532

IUPACN-(2-methoxyphenyl)-N'-(2-propan-2-yloxyphenyl)propanediamide
SMILESCOc1ccccc1NC(=O)CC(=O)Nc1ccccc1OC(C)C
InChIInChI=1S/C19H22N2O4/c1-13(2)25-17-11-7-5-9-15(17)21-19(23)12-18(22)20-14-8-4-6-10-16(14)24-3/h4-11,13H,12H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyJDQMSKBJMKBONC-UHFFFAOYSA-N
MW342.40 g/mol
LogP3.45
Rot. Bonds7

About N-(2-methoxyphenyl)-N'-(2-propan-2-yloxyphenyl)propanediamide

N-(2-methoxyphenyl)-N'-(2-propan-2-yloxyphenyl)propanediamide (PubChem CID 108955532) has the molecular formula C19H22N2O4 and a molecular weight of 342.40 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-N'-(2-propan-2-yloxyphenyl)propanediamide.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-N'-(2-propan-2-yloxyphenyl)propanediamide
PubChem CID108955532
Molecular FormulaC19H22N2O4
Molecular Weight342.40 g/mol
Exact Mass342.16
IUPAC NameN-(2-methoxyphenyl)-N'-(2-propan-2-yloxyphenyl)propanediamide
SMILESCOc1ccccc1NC(=O)CC(=O)Nc1ccccc1OC(C)C
InChIInChI=1S/C19H22N2O4/c1-13(2)25-17-11-7-5-9-15(17)21-19(23)12-18(22)20-14-8-4-6-10-16(14)24-3/h4-11,13H,12H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyJDQMSKBJMKBONC-UHFFFAOYSA-N
XLogP3.45
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N'-(2-fluorophenyl)-N-(2-propan-2-yloxyphenyl)propanediamide
CID 108954759
N'-(2-chlorophenyl)-N-(2-propan-2-yloxyphenyl)propanediamide
CID 108954883
N-(3-methoxyphenyl)-N'-(2-propan-2-yloxyphenyl)propanediamide
CID 108955569
N-(4-fluorophenyl)-N'-(2-propan-2-yloxyphenyl)propanediamide
CID 108954811
2-[2-(2-methoxyphenyl)ethylamino]-N-(2-propan-2-yloxyphenyl)acetamide
CID 109000681
N-benzyl-N'-(2-propan-2-yloxyphenyl)propanediamide
CID 108945297
2-propan-2-yloxy-N-(2-propan-2-yloxyphenyl)acetamide
CID 112687005
N'-(2-propan-2-yloxyphenyl)-N-(2,3,4-trifluorophenyl)propanediamide
CID 108955874
N,N'-bis(2-propan-2-yloxyphenyl)oxamide
CID 108987298
N-(2-methoxyphenyl)-N'-(1-phenylethyl)propanediamide
CID 108945965
N-pentyl-N'-(2-propan-2-yloxyphenyl)propanediamide
CID 108951934
N-cyclopentyl-N'-(2-propan-2-yloxyphenyl)propanediamide
CID 108942247

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-N'-(2-propan-2-yloxyphenyl)propanediamide?
The IUPAC name of N-(2-methoxyphenyl)-N'-(2-propan-2-yloxyphenyl)propanediamide (CID 108955532) is N-(2-methoxyphenyl)-N'-(2-propan-2-yloxyphenyl)propanediamide.
What is the SMILES notation for N-(2-methoxyphenyl)-N'-(2-propan-2-yloxyphenyl)propanediamide?
The canonical SMILES for N-(2-methoxyphenyl)-N'-(2-propan-2-yloxyphenyl)propanediamide is COc1ccccc1NC(=O)CC(=O)Nc1ccccc1OC(C)C.
What is the InChIKey of N-(2-methoxyphenyl)-N'-(2-propan-2-yloxyphenyl)propanediamide?
The InChIKey is JDQMSKBJMKBONC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O4/c1-13(2)25-17-11-7-5-9-15(17)21-19(23)12-18(22)20-14-8-4-6-10-16(14)24-3/h4-11,13H,12H2,1-3H3,(H,20,22)(H,21,23).
What are the key properties of N-(2-methoxyphenyl)-N'-(2-propan-2-yloxyphenyl)propanediamide?
N-(2-methoxyphenyl)-N'-(2-propan-2-yloxyphenyl)propanediamide has a molecular weight of 342.40 g/mol, XLogP of 3.45, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-N'-(2-propan-2-yloxyphenyl)propanediamide is sourced from PubChem (CID 108955532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).