2-(2-chloro-4-methylphenoxy)-2-phenylacetohydrazide

C15H15ClN2O2 — CID 63569668

IUPAC2-(2-chloro-4-methylphenoxy)-2-phenylacetohydrazide
SMILESCc1ccc(OC(C(=O)NN)c2ccccc2)c(Cl)c1
InChIInChI=1S/C15H15ClN2O2/c1-10-7-8-13(12(16)9-10)20-14(15(19)18-17)11-5-3-2-4-6-11/h2-9,14H,17H2,1H3,(H,18,19)
InChIKeyIXPYSJUJAGUZLR-UHFFFAOYSA-N
MW290.75 g/mol
LogP2.76
Rot. Bonds4

About 2-(2-chloro-4-methylphenoxy)-2-phenylacetohydrazide

2-(2-chloro-4-methylphenoxy)-2-phenylacetohydrazide (PubChem CID 63569668) has the molecular formula C15H15ClN2O2 and a molecular weight of 290.75 g/mol. Its IUPAC name is 2-(2-chloro-4-methylphenoxy)-2-phenylacetohydrazide.

Molecular Properties

Compound Name2-(2-chloro-4-methylphenoxy)-2-phenylacetohydrazide
PubChem CID63569668
Molecular FormulaC15H15ClN2O2
Molecular Weight290.75 g/mol
Exact Mass290.08
IUPAC Name2-(2-chloro-4-methylphenoxy)-2-phenylacetohydrazide
SMILESCc1ccc(OC(C(=O)NN)c2ccccc2)c(Cl)c1
InChIInChI=1S/C15H15ClN2O2/c1-10-7-8-13(12(16)9-10)20-14(15(19)18-17)11-5-3-2-4-6-11/h2-9,14H,17H2,1H3,(H,18,19)
InChIKeyIXPYSJUJAGUZLR-UHFFFAOYSA-N
XLogP2.76
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.75
LogP ≤ 52.76
H-Bond Donors ≤ 52
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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Related Compounds

2-(4-bromo-2-methylphenoxy)-2-phenylacetohydrazide
CID 63570205
2-(3,5-dimethylphenoxy)-2-phenylacetohydrazide
CID 63576169
2-(2-fluorophenoxy)-2-phenylacetohydrazide
CID 63576514
2-(2-hydrazinyl-2-oxo-1-phenylethoxy)benzamide
CID 63576718
methyl 2-(2-chlorophenoxy)-2-phenylacetate
CID 102391876
(2S)-2-(2,4-dichlorophenoxy)-2-phenylacetic acid
CID 42233563
2-(2-fluoro-4-formylphenoxy)-2-phenylacetohydrazide
CID 107693702
(2R)-2-(2-methoxy-4-methylphenoxy)-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide
CID 40882138
(2R)-2-methoxy-N-(2-methoxy-5-methylphenyl)-2-phenylacetamide
CID 883174
2-[2-[(2-chloro-4-methylphenoxy)methyl]phenyl]acetohydrazide
CID 115465245
2-(2-chloro-4-fluorophenoxy)-N-[2-(ethylamino)ethyl]-2-phenylacetamide;hydrochloride
CID 119506314
2-[(2-chlorophenyl)methoxy]-2-phenylacetohydrazide
CID 63588720

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-4-methylphenoxy)-2-phenylacetohydrazide?
The IUPAC name of 2-(2-chloro-4-methylphenoxy)-2-phenylacetohydrazide (CID 63569668) is 2-(2-chloro-4-methylphenoxy)-2-phenylacetohydrazide.
What is the SMILES notation for 2-(2-chloro-4-methylphenoxy)-2-phenylacetohydrazide?
The canonical SMILES for 2-(2-chloro-4-methylphenoxy)-2-phenylacetohydrazide is Cc1ccc(OC(C(=O)NN)c2ccccc2)c(Cl)c1.
What is the InChIKey of 2-(2-chloro-4-methylphenoxy)-2-phenylacetohydrazide?
The InChIKey is IXPYSJUJAGUZLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O2/c1-10-7-8-13(12(16)9-10)20-14(15(19)18-17)11-5-3-2-4-6-11/h2-9,14H,17H2,1H3,(H,18,19).
What are the key properties of 2-(2-chloro-4-methylphenoxy)-2-phenylacetohydrazide?
2-(2-chloro-4-methylphenoxy)-2-phenylacetohydrazide has a molecular weight of 290.75 g/mol, XLogP of 2.76, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-4-methylphenoxy)-2-phenylacetohydrazide is sourced from PubChem (CID 63569668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).