2-methoxy-N,5-dimethylbenzohydrazide

C10H14N2O2 — CID 116845575

IUPAC2-methoxy-N,5-dimethylbenzohydrazide
SMILESCOc1ccc(C)cc1C(=O)N(C)N
InChIInChI=1S/C10H14N2O2/c1-7-4-5-9(14-3)8(6-7)10(13)12(2)11/h4-6H,11H2,1-3H3
InChIKeyJENMANOASVGEHJ-UHFFFAOYSA-N
MW194.23 g/mol
LogP0.95
Rot. Bonds2

About 2-methoxy-N,5-dimethylbenzohydrazide

2-methoxy-N,5-dimethylbenzohydrazide (PubChem CID 116845575) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is 2-methoxy-N,5-dimethylbenzohydrazide.

Molecular Properties

Compound Name2-methoxy-N,5-dimethylbenzohydrazide
PubChem CID116845575
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name2-methoxy-N,5-dimethylbenzohydrazide
SMILESCOc1ccc(C)cc1C(=O)N(C)N
InChIInChI=1S/C10H14N2O2/c1-7-4-5-9(14-3)8(6-7)10(13)12(2)11/h4-6H,11H2,1-3H3
InChIKeyJENMANOASVGEHJ-UHFFFAOYSA-N
XLogP0.95
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 50.95
H-Bond Donors ≤ 51
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-methoxy-N,5-dimethylbenzohydrazide?
The IUPAC name of 2-methoxy-N,5-dimethylbenzohydrazide (CID 116845575) is 2-methoxy-N,5-dimethylbenzohydrazide.
What is the SMILES notation for 2-methoxy-N,5-dimethylbenzohydrazide?
The canonical SMILES for 2-methoxy-N,5-dimethylbenzohydrazide is COc1ccc(C)cc1C(=O)N(C)N.
What is the InChIKey of 2-methoxy-N,5-dimethylbenzohydrazide?
The InChIKey is JENMANOASVGEHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-7-4-5-9(14-3)8(6-7)10(13)12(2)11/h4-6H,11H2,1-3H3.
What are the key properties of 2-methoxy-N,5-dimethylbenzohydrazide?
2-methoxy-N,5-dimethylbenzohydrazide has a molecular weight of 194.23 g/mol, XLogP of 0.95, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N,5-dimethylbenzohydrazide is sourced from PubChem (CID 116845575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).