2,5-dichloro-N'-(2-phenoxypropanoyl)benzohydrazide

C16H14Cl2N2O3 — CID 18158718

IUPAC2,5-dichloro-N'-(2-phenoxypropanoyl)benzohydrazide
SMILESCC(Oc1ccccc1)C(=O)NNC(=O)c1cc(Cl)ccc1Cl
InChIInChI=1S/C16H14Cl2N2O3/c1-10(23-12-5-3-2-4-6-12)15(21)19-20-16(22)13-9-11(17)7-8-14(13)18/h2-10H,1H3,(H,19,21)(H,20,22)
InChIKeyFKLLMJXIFKLONP-UHFFFAOYSA-N
MW353.21 g/mol
LogP3.22
Rot. Bonds4

About 2,5-dichloro-N'-(2-phenoxypropanoyl)benzohydrazide

2,5-dichloro-N'-(2-phenoxypropanoyl)benzohydrazide (PubChem CID 18158718) has the molecular formula C16H14Cl2N2O3 and a molecular weight of 353.21 g/mol. Its IUPAC name is 2,5-dichloro-N'-(2-phenoxypropanoyl)benzohydrazide.

Molecular Properties

Compound Name2,5-dichloro-N'-(2-phenoxypropanoyl)benzohydrazide
PubChem CID18158718
Molecular FormulaC16H14Cl2N2O3
Molecular Weight353.21 g/mol
Exact Mass352.04
IUPAC Name2,5-dichloro-N'-(2-phenoxypropanoyl)benzohydrazide
SMILESCC(Oc1ccccc1)C(=O)NNC(=O)c1cc(Cl)ccc1Cl
InChIInChI=1S/C16H14Cl2N2O3/c1-10(23-12-5-3-2-4-6-12)15(21)19-20-16(22)13-9-11(17)7-8-14(13)18/h2-10H,1H3,(H,19,21)(H,20,22)
InChIKeyFKLLMJXIFKLONP-UHFFFAOYSA-N
XLogP3.22
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.21
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2,5-dichloro-N'-(2-phenylmethoxypropanoyl)benzohydrazide
CID 86983287
2,5-dichloro-N'-[2-(2,3-dimethylphenoxy)propanoyl]benzohydrazide
CID 42996241
2-[[2-(2,4-dichlorophenoxy)propanoylamino]carbamoyl]benzoic acid
CID 3349728
(2R)-N-(2,5-dichlorophenyl)-2-phenoxypropanamide
CID 7723452
5-chloro-2-methoxy-N'-(2-naphthalen-2-yloxypropanoyl)benzohydrazide
CID 43003624
5-chloro-2-fluoro-N'-[(2S)-2-(2-fluorophenoxy)propanoyl]benzohydrazide
CID 9087475
5-chloro-N'-[(2S)-2-(4-ethoxyphenoxy)propanoyl]-2-fluorobenzohydrazide
CID 9088683
4-chloro-N'-[2-(3,4-dichlorophenoxy)propanoyl]-2-methoxybenzohydrazide
CID 55821337
N'-acetyl-2-phenoxypropanehydrazide
CID 43011734
N'-[2-(4-chlorophenoxy)propanoyl]-2,5-dimethylfuran-3-carbohydrazide
CID 51145728
4-chloro-2-methoxy-N'-[2-(3-propan-2-ylphenoxy)propanoyl]benzohydrazide
CID 55821592
2,3-dichloro-N'-(2-naphthalen-2-yloxypropanoyl)benzohydrazide
CID 43003659

Frequently Asked Questions

What is the IUPAC name of 2,5-dichloro-N'-(2-phenoxypropanoyl)benzohydrazide?
The IUPAC name of 2,5-dichloro-N'-(2-phenoxypropanoyl)benzohydrazide (CID 18158718) is 2,5-dichloro-N'-(2-phenoxypropanoyl)benzohydrazide.
What is the SMILES notation for 2,5-dichloro-N'-(2-phenoxypropanoyl)benzohydrazide?
The canonical SMILES for 2,5-dichloro-N'-(2-phenoxypropanoyl)benzohydrazide is CC(Oc1ccccc1)C(=O)NNC(=O)c1cc(Cl)ccc1Cl.
What is the InChIKey of 2,5-dichloro-N'-(2-phenoxypropanoyl)benzohydrazide?
The InChIKey is FKLLMJXIFKLONP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14Cl2N2O3/c1-10(23-12-5-3-2-4-6-12)15(21)19-20-16(22)13-9-11(17)7-8-14(13)18/h2-10H,1H3,(H,19,21)(H,20,22).
What are the key properties of 2,5-dichloro-N'-(2-phenoxypropanoyl)benzohydrazide?
2,5-dichloro-N'-(2-phenoxypropanoyl)benzohydrazide has a molecular weight of 353.21 g/mol, XLogP of 3.22, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dichloro-N'-(2-phenoxypropanoyl)benzohydrazide is sourced from PubChem (CID 18158718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).