2-[2-[2-(2,4-dichlorophenoxy)propanoyl]hydrazinyl]-2-oxo-N-phenylacetamide

C17H15Cl2N3O4 — CID 17078734

IUPAC2-[2-[2-(2,4-dichlorophenoxy)propanoyl]hydrazinyl]-2-oxo-N-phenylacetamide
SMILESCC(Oc1ccc(Cl)cc1Cl)C(=O)NNC(=O)C(=O)Nc1ccccc1
InChIInChI=1S/C17H15Cl2N3O4/c1-10(26-14-8-7-11(18)9-13(14)19)15(23)21-22-17(25)16(24)20-12-5-3-2-4-6-12/h2-10H,1H3,(H,20,24)(H,21,23)(H,22,25)
InChIKeyDHIUKBBMUFQBBO-UHFFFAOYSA-N
MW396.23 g/mol
LogP2.55
Rot. Bonds4

About 2-[2-[2-(2,4-dichlorophenoxy)propanoyl]hydrazinyl]-2-oxo-N-phenylacetamide

2-[2-[2-(2,4-dichlorophenoxy)propanoyl]hydrazinyl]-2-oxo-N-phenylacetamide (PubChem CID 17078734) has the molecular formula C17H15Cl2N3O4 and a molecular weight of 396.23 g/mol. Its IUPAC name is 2-[2-[2-(2,4-dichlorophenoxy)propanoyl]hydrazinyl]-2-oxo-N-phenylacetamide.

Molecular Properties

Compound Name2-[2-[2-(2,4-dichlorophenoxy)propanoyl]hydrazinyl]-2-oxo-N-phenylacetamide
PubChem CID17078734
Molecular FormulaC17H15Cl2N3O4
Molecular Weight396.23 g/mol
Exact Mass395.04
IUPAC Name2-[2-[2-(2,4-dichlorophenoxy)propanoyl]hydrazinyl]-2-oxo-N-phenylacetamide
SMILESCC(Oc1ccc(Cl)cc1Cl)C(=O)NNC(=O)C(=O)Nc1ccccc1
InChIInChI=1S/C17H15Cl2N3O4/c1-10(26-14-8-7-11(18)9-13(14)19)15(23)21-22-17(25)16(24)20-12-5-3-2-4-6-12/h2-10H,1H3,(H,20,24)(H,21,23)(H,22,25)
InChIKeyDHIUKBBMUFQBBO-UHFFFAOYSA-N
XLogP2.55
TPSA96.53 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.23
LogP ≤ 52.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-[2-[(2S)-2-(2,4-dichlorophenoxy)propanoyl]hydrazinyl]-N-(4-methylphenyl)-2-oxoacetamide
CID 7386268
2-(2,4-dichlorophenoxy)-N-(phenylcarbamoyl)propanamide
CID 24569411
N-[4-[[[(2R)-2-(2,4-dichlorophenoxy)propanoyl]amino]carbamoyl]phenyl]benzamide
CID 2210922
N-[4-[[(2S)-2-(2,4-dichlorophenoxy)propanoyl]amino]phenyl]-2-methylpropanamide
CID 1293450
(2R)-N-(4-acetamidophenyl)-2-(2,4-dichlorophenoxy)propanamide
CID 1010932
2-[[2-(2,4-dichlorophenoxy)propanoylamino]carbamoyl]benzoic acid
CID 3349728
(2R)-2-(2,4-dichlorophenoxy)-N-(4-propan-2-ylphenyl)propanamide
CID 1335441
(2R)-2-(4-chloro-2-methylphenoxy)-N-phenylpropanamide
CID 723976
1-N',4-N'-bis[2-(2,4-dichlorophenoxy)propanoyl]benzene-1,4-dicarbohydrazide
CID 3359373
(2R)-2-(2,4-dichlorophenoxy)-N-(3-methylphenyl)propanamide
CID 2164297
N-(4-bromophenyl)-2-(2,4-dichlorophenoxy)propanamide
CID 2725599
4-[2-[2-(2-bromo-4-chlorophenoxy)propanoyl]hydrazinyl]-4-oxo-N-phenylbutanamide
CID 4981485

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-(2,4-dichlorophenoxy)propanoyl]hydrazinyl]-2-oxo-N-phenylacetamide?
The IUPAC name of 2-[2-[2-(2,4-dichlorophenoxy)propanoyl]hydrazinyl]-2-oxo-N-phenylacetamide (CID 17078734) is 2-[2-[2-(2,4-dichlorophenoxy)propanoyl]hydrazinyl]-2-oxo-N-phenylacetamide.
What is the SMILES notation for 2-[2-[2-(2,4-dichlorophenoxy)propanoyl]hydrazinyl]-2-oxo-N-phenylacetamide?
The canonical SMILES for 2-[2-[2-(2,4-dichlorophenoxy)propanoyl]hydrazinyl]-2-oxo-N-phenylacetamide is CC(Oc1ccc(Cl)cc1Cl)C(=O)NNC(=O)C(=O)Nc1ccccc1.
What is the InChIKey of 2-[2-[2-(2,4-dichlorophenoxy)propanoyl]hydrazinyl]-2-oxo-N-phenylacetamide?
The InChIKey is DHIUKBBMUFQBBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15Cl2N3O4/c1-10(26-14-8-7-11(18)9-13(14)19)15(23)21-22-17(25)16(24)20-12-5-3-2-4-6-12/h2-10H,1H3,(H,20,24)(H,21,23)(H,22,25).
What are the key properties of 2-[2-[2-(2,4-dichlorophenoxy)propanoyl]hydrazinyl]-2-oxo-N-phenylacetamide?
2-[2-[2-(2,4-dichlorophenoxy)propanoyl]hydrazinyl]-2-oxo-N-phenylacetamide has a molecular weight of 396.23 g/mol, XLogP of 2.55, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-(2,4-dichlorophenoxy)propanoyl]hydrazinyl]-2-oxo-N-phenylacetamide is sourced from PubChem (CID 17078734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).