N,N'-bis(2-ethylphenyl)propanediamide

C19H22N2O2 — CID 3881876

IUPACN,N'-bis(2-ethylphenyl)propanediamide
SMILESCCc1ccccc1NC(=O)CC(=O)Nc1ccccc1CC
InChIInChI=1S/C19H22N2O2/c1-3-14-9-5-7-11-16(14)20-18(22)13-19(23)21-17-12-8-6-10-15(17)4-2/h5-12H,3-4,13H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyHJMHUGOCWUHRRI-UHFFFAOYSA-N
MW310.40 g/mol
LogP3.78
Rot. Bonds6

About N,N'-bis(2-ethylphenyl)propanediamide

N,N'-bis(2-ethylphenyl)propanediamide (PubChem CID 3881876) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is N,N'-bis(2-ethylphenyl)propanediamide.

Molecular Properties

Compound NameN,N'-bis(2-ethylphenyl)propanediamide
PubChem CID3881876
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC NameN,N'-bis(2-ethylphenyl)propanediamide
SMILESCCc1ccccc1NC(=O)CC(=O)Nc1ccccc1CC
InChIInChI=1S/C19H22N2O2/c1-3-14-9-5-7-11-16(14)20-18(22)13-19(23)21-17-12-8-6-10-15(17)4-2/h5-12H,3-4,13H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyHJMHUGOCWUHRRI-UHFFFAOYSA-N
XLogP3.78
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 53.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N'-(2,6-diethylphenyl)-N-(2-ethylphenyl)propanediamide
CID 108953932
N'-(2-ethylphenyl)-N-propylpropanediamide
CID 108940680
N-benzyl-N'-(2-ethylphenyl)propanediamide
CID 108945270
N-(4-acetylphenyl)-N'-(2-ethylphenyl)propanediamide
CID 108953959
N-(2-ethylphenyl)undecanamide
CID 5078439
N-(2-ethylphenyl)-2-naphthalen-1-ylacetamide
CID 1228282
N-(2-ethylphenyl)heptanamide
CID 4582103
(3Z)-3-(acetylhydrazinylidene)-N-(2-ethylphenyl)butanamide
CID 5371000
1-N,2-N-bis(2-ethylphenyl)benzene-1,2-dicarboxamide
CID 4151337
2-(dipropylamino)-N-(2-ethylphenyl)acetamide
CID 109006597
N-(2-ethylphenyl)-2-(methanesulfonamido)acetamide
CID 47013160
4-(2-ethylanilino)-2,2-dimethyl-4-oxobutanoic acid
CID 65297764

Frequently Asked Questions

What is the IUPAC name of N,N'-bis(2-ethylphenyl)propanediamide?
The IUPAC name of N,N'-bis(2-ethylphenyl)propanediamide (CID 3881876) is N,N'-bis(2-ethylphenyl)propanediamide.
What is the SMILES notation for N,N'-bis(2-ethylphenyl)propanediamide?
The canonical SMILES for N,N'-bis(2-ethylphenyl)propanediamide is CCc1ccccc1NC(=O)CC(=O)Nc1ccccc1CC.
What is the InChIKey of N,N'-bis(2-ethylphenyl)propanediamide?
The InChIKey is HJMHUGOCWUHRRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2/c1-3-14-9-5-7-11-16(14)20-18(22)13-19(23)21-17-12-8-6-10-15(17)4-2/h5-12H,3-4,13H2,1-2H3,(H,20,22)(H,21,23).
What are the key properties of N,N'-bis(2-ethylphenyl)propanediamide?
N,N'-bis(2-ethylphenyl)propanediamide has a molecular weight of 310.40 g/mol, XLogP of 3.78, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-bis(2-ethylphenyl)propanediamide is sourced from PubChem (CID 3881876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).