2-(4-chlorophenyl)-2-hydroxyacetohydrazide

C8H9ClN2O2 — CID 2852687

IUPAC2-(4-chlorophenyl)-2-hydroxyacetohydrazide
SMILESNNC(=O)C(O)c1ccc(Cl)cc1
InChIInChI=1S/C8H9ClN2O2/c9-6-3-1-5(2-4-6)7(12)8(13)11-10/h1-4,7,12H,10H2,(H,11,13)
InChIKeyKAFNSTFNTQWPOT-UHFFFAOYSA-N
MW200.63 g/mol
LogP0.36
Rot. Bonds2

About 2-(4-chlorophenyl)-2-hydroxyacetohydrazide

2-(4-chlorophenyl)-2-hydroxyacetohydrazide (PubChem CID 2852687) has the molecular formula C8H9ClN2O2 and a molecular weight of 200.63 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-2-hydroxyacetohydrazide.

Molecular Properties

Compound Name2-(4-chlorophenyl)-2-hydroxyacetohydrazide
PubChem CID2852687
Molecular FormulaC8H9ClN2O2
Molecular Weight200.63 g/mol
Exact Mass200.04
IUPAC Name2-(4-chlorophenyl)-2-hydroxyacetohydrazide
SMILESNNC(=O)C(O)c1ccc(Cl)cc1
InChIInChI=1S/C8H9ClN2O2/c9-6-3-1-5(2-4-6)7(12)8(13)11-10/h1-4,7,12H,10H2,(H,11,13)
InChIKeyKAFNSTFNTQWPOT-UHFFFAOYSA-N
XLogP0.36
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.63
LogP ≤ 50.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-2-hydroxyacetohydrazide?
The IUPAC name of 2-(4-chlorophenyl)-2-hydroxyacetohydrazide (CID 2852687) is 2-(4-chlorophenyl)-2-hydroxyacetohydrazide.
What is the SMILES notation for 2-(4-chlorophenyl)-2-hydroxyacetohydrazide?
The canonical SMILES for 2-(4-chlorophenyl)-2-hydroxyacetohydrazide is NNC(=O)C(O)c1ccc(Cl)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-2-hydroxyacetohydrazide?
The InChIKey is KAFNSTFNTQWPOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9ClN2O2/c9-6-3-1-5(2-4-6)7(12)8(13)11-10/h1-4,7,12H,10H2,(H,11,13).
What are the key properties of 2-(4-chlorophenyl)-2-hydroxyacetohydrazide?
2-(4-chlorophenyl)-2-hydroxyacetohydrazide has a molecular weight of 200.63 g/mol, XLogP of 0.36, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-2-hydroxyacetohydrazide is sourced from PubChem (CID 2852687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).