2-amino-2-(2,5-dimethylphenyl)-N',N'-dimethylacetohydrazide

C12H19N3O — CID 116849762

IUPAC2-amino-2-(2,5-dimethylphenyl)-N',N'-dimethylacetohydrazide
SMILESCc1ccc(C)c(C(N)C(=O)NN(C)C)c1
InChIInChI=1S/C12H19N3O/c1-8-5-6-9(2)10(7-8)11(13)12(16)14-15(3)4/h5-7,11H,13H2,1-4H3,(H,14,16)
InChIKeyUVSBNRRCQXNMDJ-UHFFFAOYSA-N
MW221.30 g/mol
LogP0.90
Rot. Bonds3

About 2-amino-2-(2,5-dimethylphenyl)-N',N'-dimethylacetohydrazide

2-amino-2-(2,5-dimethylphenyl)-N',N'-dimethylacetohydrazide (PubChem CID 116849762) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is 2-amino-2-(2,5-dimethylphenyl)-N',N'-dimethylacetohydrazide.

Molecular Properties

Compound Name2-amino-2-(2,5-dimethylphenyl)-N',N'-dimethylacetohydrazide
PubChem CID116849762
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name2-amino-2-(2,5-dimethylphenyl)-N',N'-dimethylacetohydrazide
SMILESCc1ccc(C)c(C(N)C(=O)NN(C)C)c1
InChIInChI=1S/C12H19N3O/c1-8-5-6-9(2)10(7-8)11(13)12(16)14-15(3)4/h5-7,11H,13H2,1-4H3,(H,14,16)
InChIKeyUVSBNRRCQXNMDJ-UHFFFAOYSA-N
XLogP0.90
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-amino-N',N'-dimethyl-2-(2,3,5,6-tetramethylphenyl)acetohydrazide
CID 116849797
2-amino-3-(2,4-dimethylphenyl)-N',N'-dimethylpropanehydrazide
CID 116849913
2-amino-2-(2,5-difluorophenyl)-N',N'-dimethylacetohydrazide
CID 116849798
1-(2,5-dimethylphenyl)ethanamine
CID 4991344
4-amino-5-[1-(2,5-dimethylphenyl)ethylamino]-5-oxopentanoic acid
CID 64887951
dimethylamino-(2,5-dimethylphenyl)methanol
CID 116909513
2-amino-2-(2,4-dimethylphenyl)-N-methylacetohydrazide
CID 116848899
bromo-(2,5-dimethylphenyl)methanamine
CID 116947555
2-amino-2-(2,5-dimethylphenyl)acetaldehyde
CID 116938991
(4R)-4-amino-4-(2,5-dimethylphenyl)butan-1-ol
CID 55265559
2-amino-2-(3-methoxyphenyl)-N',N'-dimethylacetohydrazide
CID 116849865
methyl 4-amino-4-(2,5-dimethylphenyl)-2,2-dimethylbutanoate
CID 65298096

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(2,5-dimethylphenyl)-N',N'-dimethylacetohydrazide?
The IUPAC name of 2-amino-2-(2,5-dimethylphenyl)-N',N'-dimethylacetohydrazide (CID 116849762) is 2-amino-2-(2,5-dimethylphenyl)-N',N'-dimethylacetohydrazide.
What is the SMILES notation for 2-amino-2-(2,5-dimethylphenyl)-N',N'-dimethylacetohydrazide?
The canonical SMILES for 2-amino-2-(2,5-dimethylphenyl)-N',N'-dimethylacetohydrazide is Cc1ccc(C)c(C(N)C(=O)NN(C)C)c1.
What is the InChIKey of 2-amino-2-(2,5-dimethylphenyl)-N',N'-dimethylacetohydrazide?
The InChIKey is UVSBNRRCQXNMDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-8-5-6-9(2)10(7-8)11(13)12(16)14-15(3)4/h5-7,11H,13H2,1-4H3,(H,14,16).
What are the key properties of 2-amino-2-(2,5-dimethylphenyl)-N',N'-dimethylacetohydrazide?
2-amino-2-(2,5-dimethylphenyl)-N',N'-dimethylacetohydrazide has a molecular weight of 221.30 g/mol, XLogP of 0.90, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(2,5-dimethylphenyl)-N',N'-dimethylacetohydrazide is sourced from PubChem (CID 116849762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).