[2-(propan-2-yloxymethyl)phenyl]methylidenehydrazine

C11H16N2O — CID 168529363

IUPAC[2-(propan-2-yloxymethyl)phenyl]methylidenehydrazine
SMILESCC(C)OCc1ccccc1C=NN
InChIInChI=1S/C11H16N2O/c1-9(2)14-8-11-6-4-3-5-10(11)7-13-12/h3-7,9H,8,12H2,1-2H3
InChIKeyYWCDKHJFITZUFF-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.90
Rot. Bonds4

About [2-(propan-2-yloxymethyl)phenyl]methylidenehydrazine

[2-(propan-2-yloxymethyl)phenyl]methylidenehydrazine (PubChem CID 168529363) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is [2-(propan-2-yloxymethyl)phenyl]methylidenehydrazine.

Molecular Properties

Compound Name[2-(propan-2-yloxymethyl)phenyl]methylidenehydrazine
PubChem CID168529363
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name[2-(propan-2-yloxymethyl)phenyl]methylidenehydrazine
SMILESCC(C)OCc1ccccc1C=NN
InChIInChI=1S/C11H16N2O/c1-9(2)14-8-11-6-4-3-5-10(11)7-13-12/h3-7,9H,8,12H2,1-2H3
InChIKeyYWCDKHJFITZUFF-UHFFFAOYSA-N
XLogP1.90
TPSA47.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', '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-(propan-2-yloxymethyl)phenyl]methylidenehydrazine?
The IUPAC name of [2-(propan-2-yloxymethyl)phenyl]methylidenehydrazine (CID 168529363) is [2-(propan-2-yloxymethyl)phenyl]methylidenehydrazine.
What is the SMILES notation for [2-(propan-2-yloxymethyl)phenyl]methylidenehydrazine?
The canonical SMILES for [2-(propan-2-yloxymethyl)phenyl]methylidenehydrazine is CC(C)OCc1ccccc1C=NN.
What is the InChIKey of [2-(propan-2-yloxymethyl)phenyl]methylidenehydrazine?
The InChIKey is YWCDKHJFITZUFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-9(2)14-8-11-6-4-3-5-10(11)7-13-12/h3-7,9H,8,12H2,1-2H3.
What are the key properties of [2-(propan-2-yloxymethyl)phenyl]methylidenehydrazine?
[2-(propan-2-yloxymethyl)phenyl]methylidenehydrazine has a molecular weight of 192.26 g/mol, XLogP of 1.90, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(propan-2-yloxymethyl)phenyl]methylidenehydrazine is sourced from PubChem (CID 168529363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).