N'-chloro-2-phenoxyacetohydrazide

C8H9ClN2O2 — CID 174818653

IUPACN'-chloro-2-phenoxyacetohydrazide
SMILESO=C(COc1ccccc1)NNCl
InChIInChI=1S/C8H9ClN2O2/c9-11-10-8(12)6-13-7-4-2-1-3-5-7/h1-5,11H,6H2,(H,10,12)
InChIKeyWDDISRUKNWWRTI-UHFFFAOYSA-N
MW200.63 g/mol
LogP0.84
Rot. Bonds4

About N'-chloro-2-phenoxyacetohydrazide

N'-chloro-2-phenoxyacetohydrazide (PubChem CID 174818653) has the molecular formula C8H9ClN2O2 and a molecular weight of 200.63 g/mol. Its IUPAC name is N'-chloro-2-phenoxyacetohydrazide.

Molecular Properties

Compound NameN'-chloro-2-phenoxyacetohydrazide
PubChem CID174818653
Molecular FormulaC8H9ClN2O2
Molecular Weight200.63 g/mol
Exact Mass200.04
IUPAC NameN'-chloro-2-phenoxyacetohydrazide
SMILESO=C(COc1ccccc1)NNCl
InChIInChI=1S/C8H9ClN2O2/c9-11-10-8(12)6-13-7-4-2-1-3-5-7/h1-5,11H,6H2,(H,10,12)
InChIKeyWDDISRUKNWWRTI-UHFFFAOYSA-N
XLogP0.84
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.63
LogP ≤ 50.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N'-(2-phenoxyacetyl)propanehydrazide
CID 4508940
4-oxo-4-[2-(2-phenoxyacetyl)hydrazinyl]butanoate
CID 7027212
N-(hydroxymethyl)-2-phenoxyacetamide
CID 12769641
(Z)-2-[(2-phenoxyacetyl)amino]but-2-enoic acid
CID 24974135
2-phenoxy-N-propan-2-ylacetamide
CID 3614481
N-[2,2-dimethyl-3-(methylamino)propyl]-2-phenoxyacetamide
CID 115267300
2-(4-phenoxyphenoxy)-N'-phenylacetohydrazide
CID 78835711
chloromethane;2-phenoxyacetic acid
CID 157255542
2-(4-phenoxyphenoxy)acetohydrazide
CID 873173
N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-phenoxyacetamide
CID 58879695
2-phenoxy-N'-(1-phenylethyl)acetohydrazide
CID 23275370
2-phenoxyacetic acid;titanium
CID 174896747

Frequently Asked Questions

What is the IUPAC name of N'-chloro-2-phenoxyacetohydrazide?
The IUPAC name of N'-chloro-2-phenoxyacetohydrazide (CID 174818653) is N'-chloro-2-phenoxyacetohydrazide.
What is the SMILES notation for N'-chloro-2-phenoxyacetohydrazide?
The canonical SMILES for N'-chloro-2-phenoxyacetohydrazide is O=C(COc1ccccc1)NNCl.
What is the InChIKey of N'-chloro-2-phenoxyacetohydrazide?
The InChIKey is WDDISRUKNWWRTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9ClN2O2/c9-11-10-8(12)6-13-7-4-2-1-3-5-7/h1-5,11H,6H2,(H,10,12).
What are the key properties of N'-chloro-2-phenoxyacetohydrazide?
N'-chloro-2-phenoxyacetohydrazide has a molecular weight of 200.63 g/mol, XLogP of 0.84, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-chloro-2-phenoxyacetohydrazide is sourced from PubChem (CID 174818653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).