N'-[2-(2,4-dichlorophenoxy)acetyl]-3-phenoxypropanehydrazide

C17H16Cl2N2O4 — CID 19168021

IUPACN'-[2-(2,4-dichlorophenoxy)acetyl]-3-phenoxypropanehydrazide
SMILESO=C(CCOc1ccccc1)NNC(=O)COc1ccc(Cl)cc1Cl
InChIInChI=1S/C17H16Cl2N2O4/c18-12-6-7-15(14(19)10-12)25-11-17(23)21-20-16(22)8-9-24-13-4-2-1-3-5-13/h1-7,10H,8-9,11H2,(H,20,22)(H,21,23)
InChIKeyGUEAQHMPJPLBFE-UHFFFAOYSA-N
MW383.23 g/mol
LogP2.99
Rot. Bonds7

About N'-[2-(2,4-dichlorophenoxy)acetyl]-3-phenoxypropanehydrazide

N'-[2-(2,4-dichlorophenoxy)acetyl]-3-phenoxypropanehydrazide (PubChem CID 19168021) has the molecular formula C17H16Cl2N2O4 and a molecular weight of 383.23 g/mol. Its IUPAC name is N'-[2-(2,4-dichlorophenoxy)acetyl]-3-phenoxypropanehydrazide.

Molecular Properties

Compound NameN'-[2-(2,4-dichlorophenoxy)acetyl]-3-phenoxypropanehydrazide
PubChem CID19168021
Molecular FormulaC17H16Cl2N2O4
Molecular Weight383.23 g/mol
Exact Mass382.05
IUPAC NameN'-[2-(2,4-dichlorophenoxy)acetyl]-3-phenoxypropanehydrazide
SMILESO=C(CCOc1ccccc1)NNC(=O)COc1ccc(Cl)cc1Cl
InChIInChI=1S/C17H16Cl2N2O4/c18-12-6-7-15(14(19)10-12)25-11-17(23)21-20-16(22)8-9-24-13-4-2-1-3-5-13/h1-7,10H,8-9,11H2,(H,20,22)(H,21,23)
InChIKeyGUEAQHMPJPLBFE-UHFFFAOYSA-N
XLogP2.99
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.23
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-N',5-N'-bis[2-(2,4-dichlorophenoxy)acetyl]pentanedihydrazide
CID 3363801
1-N',9-N'-bis[2-(2,4-dichlorophenoxy)acetyl]nonanedihydrazide
CID 4513160
N'-[2-(2,4-dichlorophenoxy)acetyl]-2-naphthalen-2-yloxyacetohydrazide
CID 4513496
methyl 4-[2-[2-(2,4-dichlorophenoxy)acetyl]hydrazinyl]-4-oxobutanoate
CID 575319
N'-[2-(2-bromo-4-chlorophenoxy)acetyl]-4-(2,4-dichlorophenoxy)butanehydrazide
CID 5229244
[2-(2,4-dichlorophenoxy)acetyl] 11-phenoxyundecanoate
CID 87940027
1-N',5-N'-bis[4-(2,4-dichlorophenoxy)butanoyl]pentanedihydrazide
CID 3689924
N'-[2-(2,4-dichlorophenoxy)acetyl]-4-propoxybenzohydrazide
CID 4938584
4-butoxy-N'-[2-(2,4-dichlorophenoxy)acetyl]benzohydrazide
CID 4936335
(Z)-N'-[2-(2,4-dichlorophenoxy)acetyl]-3-phenylprop-2-enehydrazide
CID 93027879
N'-[2-(2,4-dichlorophenoxy)acetyl]-3-(4-phenylpiperazin-1-yl)propanehydrazide
CID 26523702
N-[[[2-(2,4-dichlorophenoxy)acetyl]amino]carbamothioyl]-4-(2-phenylethoxy)benzamide
CID 4957177

Frequently Asked Questions

What is the IUPAC name of N'-[2-(2,4-dichlorophenoxy)acetyl]-3-phenoxypropanehydrazide?
The IUPAC name of N'-[2-(2,4-dichlorophenoxy)acetyl]-3-phenoxypropanehydrazide (CID 19168021) is N'-[2-(2,4-dichlorophenoxy)acetyl]-3-phenoxypropanehydrazide.
What is the SMILES notation for N'-[2-(2,4-dichlorophenoxy)acetyl]-3-phenoxypropanehydrazide?
The canonical SMILES for N'-[2-(2,4-dichlorophenoxy)acetyl]-3-phenoxypropanehydrazide is O=C(CCOc1ccccc1)NNC(=O)COc1ccc(Cl)cc1Cl.
What is the InChIKey of N'-[2-(2,4-dichlorophenoxy)acetyl]-3-phenoxypropanehydrazide?
The InChIKey is GUEAQHMPJPLBFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16Cl2N2O4/c18-12-6-7-15(14(19)10-12)25-11-17(23)21-20-16(22)8-9-24-13-4-2-1-3-5-13/h1-7,10H,8-9,11H2,(H,20,22)(H,21,23).
What are the key properties of N'-[2-(2,4-dichlorophenoxy)acetyl]-3-phenoxypropanehydrazide?
N'-[2-(2,4-dichlorophenoxy)acetyl]-3-phenoxypropanehydrazide has a molecular weight of 383.23 g/mol, XLogP of 2.99, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(2,4-dichlorophenoxy)acetyl]-3-phenoxypropanehydrazide is sourced from PubChem (CID 19168021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).