1-(2-hydrazinyl-3-methylphenyl)ethanone

C9H12N2O — CID 67803006

IUPAC1-(2-hydrazinyl-3-methylphenyl)ethanone
SMILESCC(=O)c1cccc(C)c1NN
InChIInChI=1S/C9H12N2O/c1-6-4-3-5-8(7(2)12)9(6)11-10/h3-5,11H,10H2,1-2H3
InChIKeyRJXCZYJBZUMRGK-UHFFFAOYSA-N
MW164.21 g/mol
LogP1.48
Rot. Bonds2

About 1-(2-hydrazinyl-3-methylphenyl)ethanone

1-(2-hydrazinyl-3-methylphenyl)ethanone (PubChem CID 67803006) has the molecular formula C9H12N2O and a molecular weight of 164.21 g/mol. Its IUPAC name is 1-(2-hydrazinyl-3-methylphenyl)ethanone.

Molecular Properties

Compound Name1-(2-hydrazinyl-3-methylphenyl)ethanone
PubChem CID67803006
Molecular FormulaC9H12N2O
Molecular Weight164.21 g/mol
Exact Mass164.09
IUPAC Name1-(2-hydrazinyl-3-methylphenyl)ethanone
SMILESCC(=O)c1cccc(C)c1NN
InChIInChI=1S/C9H12N2O/c1-6-4-3-5-8(7(2)12)9(6)11-10/h3-5,11H,10H2,1-2H3
InChIKeyRJXCZYJBZUMRGK-UHFFFAOYSA-N
XLogP1.48
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.21
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-[2-(chloroamino)-3-methylphenyl]ethanone
CID 141131299
N-(2-acetyl-6-methylphenyl)-2,2,2-trichloroacetamide
CID 89495609
2-hydrazinyl-3-methylphenol
CID 130966480
ethane;1-(2-methylphenyl)ethanone
CID 91374073
1-(5-methylnaphthalen-1-yl)ethanone
CID 15563480
2-hydrazinyl-3-methylaniline
CID 118990747
carbanide;1-(2-methylphenyl)ethanone;tris(yttrium)
CID 160605653
ethane;methoxymethane;1-(2-methylphenyl)ethanone
CID 90975384
2,3-dimethylbenzohydrazide
CID 16790549
N,N'-bis(2,6-dimethylphenyl)oxamide
CID 3764178
1-(2-acetyl-6-methylphenyl)propan-2-one
CID 58202287
(Z)-N-(2,6-dimethylphenyl)-3-hydroxybut-2-enamide
CID 139239578

Frequently Asked Questions

What is the IUPAC name of 1-(2-hydrazinyl-3-methylphenyl)ethanone?
The IUPAC name of 1-(2-hydrazinyl-3-methylphenyl)ethanone (CID 67803006) is 1-(2-hydrazinyl-3-methylphenyl)ethanone.
What is the SMILES notation for 1-(2-hydrazinyl-3-methylphenyl)ethanone?
The canonical SMILES for 1-(2-hydrazinyl-3-methylphenyl)ethanone is CC(=O)c1cccc(C)c1NN.
What is the InChIKey of 1-(2-hydrazinyl-3-methylphenyl)ethanone?
The InChIKey is RJXCZYJBZUMRGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O/c1-6-4-3-5-8(7(2)12)9(6)11-10/h3-5,11H,10H2,1-2H3.
What are the key properties of 1-(2-hydrazinyl-3-methylphenyl)ethanone?
1-(2-hydrazinyl-3-methylphenyl)ethanone has a molecular weight of 164.21 g/mol, XLogP of 1.48, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-hydrazinyl-3-methylphenyl)ethanone is sourced from PubChem (CID 67803006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).