2-(4-propan-2-ylphenoxy)acetohydrazide

C11H16N2O2 — CID 968935

IUPAC2-(4-propan-2-ylphenoxy)acetohydrazide
SMILESCC(C)c1ccc(OCC(=O)NN)cc1
InChIInChI=1S/C11H16N2O2/c1-8(2)9-3-5-10(6-4-9)15-7-11(14)13-12/h3-6,8H,7,12H2,1-2H3,(H,13,14)
InChIKeySGEKDXDLMYFJOF-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.18
Rot. Bonds4

About 2-(4-propan-2-ylphenoxy)acetohydrazide

2-(4-propan-2-ylphenoxy)acetohydrazide (PubChem CID 968935) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 2-(4-propan-2-ylphenoxy)acetohydrazide.

Molecular Properties

Compound Name2-(4-propan-2-ylphenoxy)acetohydrazide
PubChem CID968935
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name2-(4-propan-2-ylphenoxy)acetohydrazide
SMILESCC(C)c1ccc(OCC(=O)NN)cc1
InChIInChI=1S/C11H16N2O2/c1-8(2)9-3-5-10(6-4-9)15-7-11(14)13-12/h3-6,8H,7,12H2,1-2H3,(H,13,14)
InChIKeySGEKDXDLMYFJOF-UHFFFAOYSA-N
XLogP1.18
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.18
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

N-(2-aminoethyl)-2-(4-propan-2-ylphenoxy)acetamide;hydrochloride
CID 119384409
1-N',9-N'-bis[2-(4-propan-2-ylphenoxy)acetyl]nonanedihydrazide
CID 4506492
2-[[2-(4-propan-2-ylphenoxy)acetyl]amino]acetic acid
CID 9157069
N-(4-hydroxybutan-2-yl)-2-(4-propan-2-ylphenoxy)acetamide
CID 81042144
2-(4-propan-2-ylphenoxy)-N-(2,2,2-trifluoroethoxy)acetamide
CID 81339847
2-(4-propan-2-ylphenoxy)-N-(2,2,2-trifluoroethyl)acetamide
CID 39951739
N-butyl-2-(4-propan-2-ylphenoxy)acetamide
CID 17142930
N-[3-(aminomethyl)pentan-3-yl]-2-(4-propan-2-ylphenoxy)acetamide
CID 119570960
2-(4-methylsulfanylphenoxy)acetohydrazide
CID 16656066
2-(4-propan-2-ylphenoxy)-N-[(1S,2R)-2-[[2-(4-propan-2-ylphenoxy)acetyl]amino]cyclohexyl]acetamide
CID 27870934
N'-[2-(4-nitrophenoxy)acetyl]-2-(4-propan-2-ylphenoxy)acetohydrazide
CID 4502703
N'-[2-(2,6-dimethylphenoxy)acetyl]-2-(4-propan-2-ylphenoxy)acetohydrazide
CID 2210337

Frequently Asked Questions

What is the IUPAC name of 2-(4-propan-2-ylphenoxy)acetohydrazide?
The IUPAC name of 2-(4-propan-2-ylphenoxy)acetohydrazide (CID 968935) is 2-(4-propan-2-ylphenoxy)acetohydrazide.
What is the SMILES notation for 2-(4-propan-2-ylphenoxy)acetohydrazide?
The canonical SMILES for 2-(4-propan-2-ylphenoxy)acetohydrazide is CC(C)c1ccc(OCC(=O)NN)cc1.
What is the InChIKey of 2-(4-propan-2-ylphenoxy)acetohydrazide?
The InChIKey is SGEKDXDLMYFJOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-8(2)9-3-5-10(6-4-9)15-7-11(14)13-12/h3-6,8H,7,12H2,1-2H3,(H,13,14).
What are the key properties of 2-(4-propan-2-ylphenoxy)acetohydrazide?
2-(4-propan-2-ylphenoxy)acetohydrazide has a molecular weight of 208.26 g/mol, XLogP of 1.18, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-propan-2-ylphenoxy)acetohydrazide is sourced from PubChem (CID 968935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).