2-methyl-2-(3-methylphenoxy)propanehydrazide

C11H16N2O2 — CID 3079060

IUPAC2-methyl-2-(3-methylphenoxy)propanehydrazide
SMILESCc1cccc(OC(C)(C)C(=O)NN)c1
InChIInChI=1S/C11H16N2O2/c1-8-5-4-6-9(7-8)15-11(2,3)10(14)13-12/h4-7H,12H2,1-3H3,(H,13,14)
InChIKeyNKROTMDQIANJCN-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.14
Rot. Bonds3

About 2-methyl-2-(3-methylphenoxy)propanehydrazide

2-methyl-2-(3-methylphenoxy)propanehydrazide (PubChem CID 3079060) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 2-methyl-2-(3-methylphenoxy)propanehydrazide.

Molecular Properties

Compound Name2-methyl-2-(3-methylphenoxy)propanehydrazide
PubChem CID3079060
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name2-methyl-2-(3-methylphenoxy)propanehydrazide
SMILESCc1cccc(OC(C)(C)C(=O)NN)c1
InChIInChI=1S/C11H16N2O2/c1-8-5-4-6-9(7-8)15-11(2,3)10(14)13-12/h4-7H,12H2,1-3H3,(H,13,14)
InChIKeyNKROTMDQIANJCN-UHFFFAOYSA-N
XLogP1.14
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.14
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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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-(3-methylphenoxy)propanehydrazide?
The IUPAC name of 2-methyl-2-(3-methylphenoxy)propanehydrazide (CID 3079060) is 2-methyl-2-(3-methylphenoxy)propanehydrazide.
What is the SMILES notation for 2-methyl-2-(3-methylphenoxy)propanehydrazide?
The canonical SMILES for 2-methyl-2-(3-methylphenoxy)propanehydrazide is Cc1cccc(OC(C)(C)C(=O)NN)c1.
What is the InChIKey of 2-methyl-2-(3-methylphenoxy)propanehydrazide?
The InChIKey is NKROTMDQIANJCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-8-5-4-6-9(7-8)15-11(2,3)10(14)13-12/h4-7H,12H2,1-3H3,(H,13,14).
What are the key properties of 2-methyl-2-(3-methylphenoxy)propanehydrazide?
2-methyl-2-(3-methylphenoxy)propanehydrazide has a molecular weight of 208.26 g/mol, XLogP of 1.14, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-(3-methylphenoxy)propanehydrazide is sourced from PubChem (CID 3079060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).