N',N'-dimethyl-2-(2,4,6-trimethylphenyl)acetohydrazide

C13H20N2O — CID 116847434

IUPACN',N'-dimethyl-2-(2,4,6-trimethylphenyl)acetohydrazide
SMILESCc1cc(C)c(CC(=O)NN(C)C)c(C)c1
InChIInChI=1S/C13H20N2O/c1-9-6-10(2)12(11(3)7-9)8-13(16)14-15(4)5/h6-7H,8H2,1-5H3,(H,14,16)
InChIKeyYTVBGFUGCKNHRT-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.75
Rot. Bonds3

About N',N'-dimethyl-2-(2,4,6-trimethylphenyl)acetohydrazide

N',N'-dimethyl-2-(2,4,6-trimethylphenyl)acetohydrazide (PubChem CID 116847434) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is N',N'-dimethyl-2-(2,4,6-trimethylphenyl)acetohydrazide.

Molecular Properties

Compound NameN',N'-dimethyl-2-(2,4,6-trimethylphenyl)acetohydrazide
PubChem CID116847434
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC NameN',N'-dimethyl-2-(2,4,6-trimethylphenyl)acetohydrazide
SMILESCc1cc(C)c(CC(=O)NN(C)C)c(C)c1
InChIInChI=1S/C13H20N2O/c1-9-6-10(2)12(11(3)7-9)8-13(16)14-15(4)5/h6-7H,8H2,1-5H3,(H,14,16)
InChIKeyYTVBGFUGCKNHRT-UHFFFAOYSA-N
XLogP1.75
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N',N'-dimethyl-5-(2,4,6-trimethylphenyl)pentanehydrazide
CID 116847795
N-hydroxy-2-(2,4,6-trimethylphenyl)acetamide
CID 139860051
N-propan-2-yl-2-(2,4,6-trimethylphenyl)acetamide
CID 110767844
N-phenyl-2-(2,4,6-trimethylphenyl)acetamide
CID 42390776
N',N'-dimethyl-3-(2,3,5,6-tetramethylphenyl)propanehydrazide
CID 116847580
2-[[2-(2,4,6-trimethylphenyl)acetyl]amino]ethyl carbamate
CID 86787902
methyl (2S)-2-hydroxy-2-methyl-3-[[2-(2,4,6-trimethylphenyl)acetyl]amino]propanoate
CID 129358755
4-(2,5-dimethylphenyl)-N',N'-dimethylbutanehydrazide
CID 116847676
N-piperazin-1-yl-2-(2,4,6-trimethylphenyl)acetamide
CID 154489626
2-[(2,5-dimethylphenyl)methoxy]-N',N'-dimethylacetohydrazide
CID 116847844
(2,4,6-trimethylphenyl)methylcarbamic acid
CID 67124074
N-[2-(2,4,6-trimethylphenyl)ethyl]acetamide
CID 110788028

Frequently Asked Questions

What is the IUPAC name of N',N'-dimethyl-2-(2,4,6-trimethylphenyl)acetohydrazide?
The IUPAC name of N',N'-dimethyl-2-(2,4,6-trimethylphenyl)acetohydrazide (CID 116847434) is N',N'-dimethyl-2-(2,4,6-trimethylphenyl)acetohydrazide.
What is the SMILES notation for N',N'-dimethyl-2-(2,4,6-trimethylphenyl)acetohydrazide?
The canonical SMILES for N',N'-dimethyl-2-(2,4,6-trimethylphenyl)acetohydrazide is Cc1cc(C)c(CC(=O)NN(C)C)c(C)c1.
What is the InChIKey of N',N'-dimethyl-2-(2,4,6-trimethylphenyl)acetohydrazide?
The InChIKey is YTVBGFUGCKNHRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-9-6-10(2)12(11(3)7-9)8-13(16)14-15(4)5/h6-7H,8H2,1-5H3,(H,14,16).
What are the key properties of N',N'-dimethyl-2-(2,4,6-trimethylphenyl)acetohydrazide?
N',N'-dimethyl-2-(2,4,6-trimethylphenyl)acetohydrazide has a molecular weight of 220.32 g/mol, XLogP of 1.75, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-dimethyl-2-(2,4,6-trimethylphenyl)acetohydrazide is sourced from PubChem (CID 116847434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).