N'-methyl-2-(2,3,4-trimethylphenyl)propanehydrazide

C13H20N2O — CID 116847102

IUPACN'-methyl-2-(2,3,4-trimethylphenyl)propanehydrazide
SMILESCNNC(=O)C(C)c1ccc(C)c(C)c1C
InChIInChI=1S/C13H20N2O/c1-8-6-7-12(10(3)9(8)2)11(4)13(16)15-14-5/h6-7,11,14H,1-5H3,(H,15,16)
InChIKeyYHTFIQDDTQPIJI-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.97
Rot. Bonds3

About N'-methyl-2-(2,3,4-trimethylphenyl)propanehydrazide

N'-methyl-2-(2,3,4-trimethylphenyl)propanehydrazide (PubChem CID 116847102) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is N'-methyl-2-(2,3,4-trimethylphenyl)propanehydrazide.

Molecular Properties

Compound NameN'-methyl-2-(2,3,4-trimethylphenyl)propanehydrazide
PubChem CID116847102
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC NameN'-methyl-2-(2,3,4-trimethylphenyl)propanehydrazide
SMILESCNNC(=O)C(C)c1ccc(C)c(C)c1C
InChIInChI=1S/C13H20N2O/c1-8-6-7-12(10(3)9(8)2)11(4)13(16)15-14-5/h6-7,11,14H,1-5H3,(H,15,16)
InChIKeyYHTFIQDDTQPIJI-UHFFFAOYSA-N
XLogP1.97
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-(methylamino)-1-(2,3,4-trimethylphenyl)propan-2-one
CID 116955940
1-(2,3,4-trimethylphenyl)ethanol
CID 130125335
2,3-bis(methylamino)-3-(2,3,4-trimethylphenyl)propanoic acid
CID 116961134
2-(4-fluorophenyl)-N'-methylpropanehydrazide
CID 116846978
ethyl 2-(methylamino)-2-(2,3,4-trimethylphenyl)acetate
CID 116961364
2-(2-methoxy-5-propan-2-ylphenyl)-N'-methylpropanehydrazide
CID 116847004
2-(2-hydroxy-3,4-dimethylphenyl)propanoic acid
CID 83878748
(2R)-N-methyl-2-(2-methylphenyl)propanamide
CID 97305047
3-amino-3-(2,3,4-trimethylphenyl)propanamide
CID 116850990
2,2-dimethyl-4-(methylamino)-4-(2,3,4-trimethylphenyl)butanoic acid
CID 116953757
2-(2,5-difluoro-4-methoxyphenyl)-N'-methylpropanehydrazide
CID 116847082
N'-methyl-4-(2,3,4-trimethylphenyl)butanehydrazide
CID 116846569

Frequently Asked Questions

What is the IUPAC name of N'-methyl-2-(2,3,4-trimethylphenyl)propanehydrazide?
The IUPAC name of N'-methyl-2-(2,3,4-trimethylphenyl)propanehydrazide (CID 116847102) is N'-methyl-2-(2,3,4-trimethylphenyl)propanehydrazide.
What is the SMILES notation for N'-methyl-2-(2,3,4-trimethylphenyl)propanehydrazide?
The canonical SMILES for N'-methyl-2-(2,3,4-trimethylphenyl)propanehydrazide is CNNC(=O)C(C)c1ccc(C)c(C)c1C.
What is the InChIKey of N'-methyl-2-(2,3,4-trimethylphenyl)propanehydrazide?
The InChIKey is YHTFIQDDTQPIJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-8-6-7-12(10(3)9(8)2)11(4)13(16)15-14-5/h6-7,11,14H,1-5H3,(H,15,16).
What are the key properties of N'-methyl-2-(2,3,4-trimethylphenyl)propanehydrazide?
N'-methyl-2-(2,3,4-trimethylphenyl)propanehydrazide has a molecular weight of 220.32 g/mol, XLogP of 1.97, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-methyl-2-(2,3,4-trimethylphenyl)propanehydrazide is sourced from PubChem (CID 116847102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).