2-hydrazinyl-3-methylphenol

C7H10N2O — CID 130966480

IUPAC2-hydrazinyl-3-methylphenol
SMILESCc1cccc(O)c1NN
InChIInChI=1S/C7H10N2O/c1-5-3-2-4-6(10)7(5)9-8/h2-4,9-10H,8H2,1H3
InChIKeyDQGPWSDEEOVOMV-UHFFFAOYSA-N
MW138.17 g/mol
LogP0.99
Rot. Bonds1

About 2-hydrazinyl-3-methylphenol

2-hydrazinyl-3-methylphenol (PubChem CID 130966480) has the molecular formula C7H10N2O and a molecular weight of 138.17 g/mol. Its IUPAC name is 2-hydrazinyl-3-methylphenol.

Molecular Properties

Compound Name2-hydrazinyl-3-methylphenol
PubChem CID130966480
Molecular FormulaC7H10N2O
Molecular Weight138.17 g/mol
Exact Mass138.08
IUPAC Name2-hydrazinyl-3-methylphenol
SMILESCc1cccc(O)c1NN
InChIInChI=1S/C7H10N2O/c1-5-3-2-4-6(10)7(5)9-8/h2-4,9-10H,8H2,1H3
InChIKeyDQGPWSDEEOVOMV-UHFFFAOYSA-N
XLogP0.99
TPSA58.28 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 50.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol', '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-hydrazinyl-3-methylphenol?
The IUPAC name of 2-hydrazinyl-3-methylphenol (CID 130966480) is 2-hydrazinyl-3-methylphenol.
What is the SMILES notation for 2-hydrazinyl-3-methylphenol?
The canonical SMILES for 2-hydrazinyl-3-methylphenol is Cc1cccc(O)c1NN.
What is the InChIKey of 2-hydrazinyl-3-methylphenol?
The InChIKey is DQGPWSDEEOVOMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O/c1-5-3-2-4-6(10)7(5)9-8/h2-4,9-10H,8H2,1H3.
What are the key properties of 2-hydrazinyl-3-methylphenol?
2-hydrazinyl-3-methylphenol has a molecular weight of 138.17 g/mol, XLogP of 0.99, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-3-methylphenol is sourced from PubChem (CID 130966480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).