2-(2,4-dimethylphenyl)-N,2-dimethylpropanehydrazide

C13H20N2O — CID 116845892

IUPAC2-(2,4-dimethylphenyl)-N,2-dimethylpropanehydrazide
SMILESCc1ccc(C(C)(C)C(=O)N(C)N)c(C)c1
InChIInChI=1S/C13H20N2O/c1-9-6-7-11(10(2)8-9)13(3,4)12(16)15(5)14/h6-8H,14H2,1-5H3
InChIKeyNOEZVTUYWVKLEG-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.91
Rot. Bonds2

About 2-(2,4-dimethylphenyl)-N,2-dimethylpropanehydrazide

2-(2,4-dimethylphenyl)-N,2-dimethylpropanehydrazide (PubChem CID 116845892) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 2-(2,4-dimethylphenyl)-N,2-dimethylpropanehydrazide.

Molecular Properties

Compound Name2-(2,4-dimethylphenyl)-N,2-dimethylpropanehydrazide
PubChem CID116845892
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name2-(2,4-dimethylphenyl)-N,2-dimethylpropanehydrazide
SMILESCc1ccc(C(C)(C)C(=O)N(C)N)c(C)c1
InChIInChI=1S/C13H20N2O/c1-9-6-7-11(10(2)8-9)13(3,4)12(16)15(5)14/h6-8H,14H2,1-5H3
InChIKeyNOEZVTUYWVKLEG-UHFFFAOYSA-N
XLogP1.91
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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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Related Compounds

2-(4-tert-butyl-2-methylphenyl)-N,2-dimethylpropanehydrazide
CID 116845949
N,2-dimethyl-2-(2,4,6-trimethylphenyl)propanehydrazide
CID 116845906
2-amino-2-(2,4-dimethylphenyl)propanoic acid;hydrochloride
CID 82128471
1-[1,1-bis(2,4-dimethylphenyl)ethyl]-2,4-dimethylbenzene
CID 19090109
ethyl 3-amino-3-(2,4-dimethylphenyl)butanoate
CID 79848686
2-(2,4-dimethylphenyl)-2-hydroxypropanal
CID 66040527
3-(2,4-dimethylphenyl)-3-methylbutan-2-one;ethane;propan-1-ol
CID 143994165
methyl 2-(2,4-dimethylphenyl)-2-fluoropropanoate
CID 105464025
[2-(2,4-dimethylphenyl)-2-methylpropyl]carbamic acid
CID 115171380
2-amino-2-(2,4-dimethylphenyl)-N-methylacetohydrazide
CID 116848899
4-amino-N-(2,4-dimethylphenyl)-N,2,2-trimethylbutanamide
CID 115156953
N-[2-(2,4-dimethylphenyl)-2-methylpropyl]acetamide
CID 115191406

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethylphenyl)-N,2-dimethylpropanehydrazide?
The IUPAC name of 2-(2,4-dimethylphenyl)-N,2-dimethylpropanehydrazide (CID 116845892) is 2-(2,4-dimethylphenyl)-N,2-dimethylpropanehydrazide.
What is the SMILES notation for 2-(2,4-dimethylphenyl)-N,2-dimethylpropanehydrazide?
The canonical SMILES for 2-(2,4-dimethylphenyl)-N,2-dimethylpropanehydrazide is Cc1ccc(C(C)(C)C(=O)N(C)N)c(C)c1.
What is the InChIKey of 2-(2,4-dimethylphenyl)-N,2-dimethylpropanehydrazide?
The InChIKey is NOEZVTUYWVKLEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-9-6-7-11(10(2)8-9)13(3,4)12(16)15(5)14/h6-8H,14H2,1-5H3.
What are the key properties of 2-(2,4-dimethylphenyl)-N,2-dimethylpropanehydrazide?
2-(2,4-dimethylphenyl)-N,2-dimethylpropanehydrazide has a molecular weight of 220.32 g/mol, XLogP of 1.91, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethylphenyl)-N,2-dimethylpropanehydrazide is sourced from PubChem (CID 116845892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).