N-(2,3-dichlorophenyl)-2-[2-oxo-2-[2-(3-phenylpropanoyl)hydrazinyl]ethoxy]acetamide

C19H19Cl2N3O4 — CID 3412271

IUPACN-(2,3-dichlorophenyl)-2-[2-oxo-2-[2-(3-phenylpropanoyl)hydrazinyl]ethoxy]acetamide
SMILESO=C(CCc1ccccc1)NNC(=O)COCC(=O)Nc1cccc(Cl)c1Cl
InChIInChI=1S/C19H19Cl2N3O4/c20-14-7-4-8-15(19(14)21)22-17(26)11-28-12-18(27)24-23-16(25)10-9-13-5-2-1-3-6-13/h1-8H,9-12H2,(H,22,26)(H,23,25)(H,24,27)
InChIKeyGQMUVEKNNXTOJM-UHFFFAOYSA-N
MW424.28 g/mol
LogP2.73
Rot. Bonds8

About N-(2,3-dichlorophenyl)-2-[2-oxo-2-[2-(3-phenylpropanoyl)hydrazinyl]ethoxy]acetamide

N-(2,3-dichlorophenyl)-2-[2-oxo-2-[2-(3-phenylpropanoyl)hydrazinyl]ethoxy]acetamide (PubChem CID 3412271) has the molecular formula C19H19Cl2N3O4 and a molecular weight of 424.28 g/mol. Its IUPAC name is N-(2,3-dichlorophenyl)-2-[2-oxo-2-[2-(3-phenylpropanoyl)hydrazinyl]ethoxy]acetamide.

Molecular Properties

Compound NameN-(2,3-dichlorophenyl)-2-[2-oxo-2-[2-(3-phenylpropanoyl)hydrazinyl]ethoxy]acetamide
PubChem CID3412271
Molecular FormulaC19H19Cl2N3O4
Molecular Weight424.28 g/mol
Exact Mass423.08
IUPAC NameN-(2,3-dichlorophenyl)-2-[2-oxo-2-[2-(3-phenylpropanoyl)hydrazinyl]ethoxy]acetamide
SMILESO=C(CCc1ccccc1)NNC(=O)COCC(=O)Nc1cccc(Cl)c1Cl
InChIInChI=1S/C19H19Cl2N3O4/c20-14-7-4-8-15(19(14)21)22-17(26)11-28-12-18(27)24-23-16(25)10-9-13-5-2-1-3-6-13/h1-8H,9-12H2,(H,22,26)(H,23,25)(H,24,27)
InChIKeyGQMUVEKNNXTOJM-UHFFFAOYSA-N
XLogP2.73
TPSA96.53 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.28
LogP ≤ 52.73
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(3-chloro-4-methylphenyl)-2-[2-oxo-2-[2-(3-phenylpropanoyl)hydrazinyl]ethoxy]acetamide
CID 3383669
N'-[2-(2-chlorophenoxy)acetyl]-3-phenylpropanehydrazide
CID 3139333
2-chloro-6-(3-phenylpropanoylamino)benzoic acid
CID 63723256
3-(3-aminophenyl)-N-(2,3-dichlorophenyl)propanamide
CID 28713636
CID 153403326
CID 153403326
N-(2,3-dichlorophenyl)-3-pyridin-3-ylpropanamide
CID 112519927
N-(2-chlorophenyl)-4-oxo-4-[2-(3-phenylpropanoylcarbamothioyl)hydrazinyl]butanamide
CID 5089778
N-(2,3-dichlorophenyl)-2-(2-oxo-2-piperidin-1-ylethoxy)acetamide
CID 4002670
N-cyclohexyl-2-[2-(2,3-dichloroanilino)-2-oxoethoxy]acetamide
CID 5116287
(2R)-4-(2,3-dichloroanilino)-4-oxo-2-(2-phenylethylamino)butanoic acid
CID 40567011
2-[2-(2,3-dichloroanilino)-2-oxoethoxy]-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
CID 5135119
3-phenyl-N-[5-(3-phenylpropanoylamino)naphthalen-1-yl]propanamide
CID 1010239

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dichlorophenyl)-2-[2-oxo-2-[2-(3-phenylpropanoyl)hydrazinyl]ethoxy]acetamide?
The IUPAC name of N-(2,3-dichlorophenyl)-2-[2-oxo-2-[2-(3-phenylpropanoyl)hydrazinyl]ethoxy]acetamide (CID 3412271) is N-(2,3-dichlorophenyl)-2-[2-oxo-2-[2-(3-phenylpropanoyl)hydrazinyl]ethoxy]acetamide.
What is the SMILES notation for N-(2,3-dichlorophenyl)-2-[2-oxo-2-[2-(3-phenylpropanoyl)hydrazinyl]ethoxy]acetamide?
The canonical SMILES for N-(2,3-dichlorophenyl)-2-[2-oxo-2-[2-(3-phenylpropanoyl)hydrazinyl]ethoxy]acetamide is O=C(CCc1ccccc1)NNC(=O)COCC(=O)Nc1cccc(Cl)c1Cl.
What is the InChIKey of N-(2,3-dichlorophenyl)-2-[2-oxo-2-[2-(3-phenylpropanoyl)hydrazinyl]ethoxy]acetamide?
The InChIKey is GQMUVEKNNXTOJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19Cl2N3O4/c20-14-7-4-8-15(19(14)21)22-17(26)11-28-12-18(27)24-23-16(25)10-9-13-5-2-1-3-6-13/h1-8H,9-12H2,(H,22,26)(H,23,25)(H,24,27).
What are the key properties of N-(2,3-dichlorophenyl)-2-[2-oxo-2-[2-(3-phenylpropanoyl)hydrazinyl]ethoxy]acetamide?
N-(2,3-dichlorophenyl)-2-[2-oxo-2-[2-(3-phenylpropanoyl)hydrazinyl]ethoxy]acetamide has a molecular weight of 424.28 g/mol, XLogP of 2.73, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dichlorophenyl)-2-[2-oxo-2-[2-(3-phenylpropanoyl)hydrazinyl]ethoxy]acetamide is sourced from PubChem (CID 3412271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).