4-hydroxy-2-methyl-5-propan-2-ylbenzohydrazide

C11H16N2O2 — CID 83386284

IUPAC4-hydroxy-2-methyl-5-propan-2-ylbenzohydrazide
SMILESCc1cc(O)c(C(C)C)cc1C(=O)NN
InChIInChI=1S/C11H16N2O2/c1-6(2)8-5-9(11(15)13-12)7(3)4-10(8)14/h4-6,14H,12H2,1-3H3,(H,13,15)
InChIKeyJEVTUTZXSKYQSE-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.43
Rot. Bonds2

About 4-hydroxy-2-methyl-5-propan-2-ylbenzohydrazide

4-hydroxy-2-methyl-5-propan-2-ylbenzohydrazide (PubChem CID 83386284) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 4-hydroxy-2-methyl-5-propan-2-ylbenzohydrazide.

Molecular Properties

Compound Name4-hydroxy-2-methyl-5-propan-2-ylbenzohydrazide
PubChem CID83386284
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name4-hydroxy-2-methyl-5-propan-2-ylbenzohydrazide
SMILESCc1cc(O)c(C(C)C)cc1C(=O)NN
InChIInChI=1S/C11H16N2O2/c1-6(2)8-5-9(11(15)13-12)7(3)4-10(8)14/h4-6,14H,12H2,1-3H3,(H,13,15)
InChIKeyJEVTUTZXSKYQSE-UHFFFAOYSA-N
XLogP1.43
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.43
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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Related Compounds

3-methyl-4-propan-2-ylbenzohydrazide
CID 130427973
1-(4-hydroxy-2-methyl-5-propan-2-ylphenyl)-2-(4-methylpiperazin-1-yl)ethanone
CID 170861545
5-bromo-2-hydroxy-4-methylbenzohydrazide
CID 130090980
(4-hydroxy-2-methyl-5-propan-2-ylphenyl)methyl 2-hydroxybenzoate
CID 57116574
N-(4-hydroxy-2-methyl-5-propan-2-ylphenyl)propanamide
CID 2223120
ethyl 2-(2-hydroxy-4-methyl-5-propan-2-ylphenyl)-2-oxoacetate
CID 117378873
4-hydroxy-2-methyl-5-propan-2-yl-N-[(3S,4S)-4-pyrrolidin-1-yloxolan-3-yl]benzamide
CID 154854972
N-(4-hydroxy-2-methyl-5-propan-2-ylphenyl)-1,3-dimethylpyrazole-4-carboxamide
CID 19474826
5-methyl-4-(methylamino)-2-propan-2-ylphenol
CID 82266002
4-(hydroxyamino)-5-methyl-2-propan-2-ylphenol
CID 51003755
4-chloro-5-methyl-2-propan-2-ylphenol
CID 160599975
1-(4-hydroxy-2-methyl-5-propan-2-ylphenyl)cyclopropane-1-carboxylic acid
CID 117340569

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-2-methyl-5-propan-2-ylbenzohydrazide?
The IUPAC name of 4-hydroxy-2-methyl-5-propan-2-ylbenzohydrazide (CID 83386284) is 4-hydroxy-2-methyl-5-propan-2-ylbenzohydrazide.
What is the SMILES notation for 4-hydroxy-2-methyl-5-propan-2-ylbenzohydrazide?
The canonical SMILES for 4-hydroxy-2-methyl-5-propan-2-ylbenzohydrazide is Cc1cc(O)c(C(C)C)cc1C(=O)NN.
What is the InChIKey of 4-hydroxy-2-methyl-5-propan-2-ylbenzohydrazide?
The InChIKey is JEVTUTZXSKYQSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-6(2)8-5-9(11(15)13-12)7(3)4-10(8)14/h4-6,14H,12H2,1-3H3,(H,13,15).
What are the key properties of 4-hydroxy-2-methyl-5-propan-2-ylbenzohydrazide?
4-hydroxy-2-methyl-5-propan-2-ylbenzohydrazide has a molecular weight of 208.26 g/mol, XLogP of 1.43, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-2-methyl-5-propan-2-ylbenzohydrazide is sourced from PubChem (CID 83386284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).