2-(2,4,5-trimethylphenyl)acetohydrazide

C11H16N2O — CID 100523227

IUPAC2-(2,4,5-trimethylphenyl)acetohydrazide
SMILESCc1cc(C)c(CC(=O)NN)cc1C
InChIInChI=1S/C11H16N2O/c1-7-4-9(3)10(5-8(7)2)6-11(14)13-12/h4-5H,6,12H2,1-3H3,(H,13,14)
InChIKeyXANBKTDYUASLRX-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.14
Rot. Bonds2

About 2-(2,4,5-trimethylphenyl)acetohydrazide

2-(2,4,5-trimethylphenyl)acetohydrazide (PubChem CID 100523227) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 2-(2,4,5-trimethylphenyl)acetohydrazide.

Molecular Properties

Compound Name2-(2,4,5-trimethylphenyl)acetohydrazide
PubChem CID100523227
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name2-(2,4,5-trimethylphenyl)acetohydrazide
SMILESCc1cc(C)c(CC(=O)NN)cc1C
InChIInChI=1S/C11H16N2O/c1-7-4-9(3)10(5-8(7)2)6-11(14)13-12/h4-5H,6,12H2,1-3H3,(H,13,14)
InChIKeyXANBKTDYUASLRX-UHFFFAOYSA-N
XLogP1.14
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.14
H-Bond Donors ≤ 52
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

3-(2,4,5-trimethylphenyl)propanehydrazide
CID 116843486
4-(2,4,5-trimethylphenyl)butanehydrazide
CID 116843610
2-(4-bromo-2-methylphenyl)acetohydrazide
CID 166828738
N-[(2,4,5-trimethylphenyl)methyl]propanamide
CID 110783031
N-(3-hydroxypropyl)-2-(2,4,5-trimethylphenyl)acetamide
CID 96661088
2-[4-[2-(3,4-dimethylphenyl)ethyl]phenyl]acetohydrazide
CID 58181343
3-amino-1-methyl-1-[2-(2,4,5-trimethylphenyl)ethyl]urea
CID 115193053
2-sulfanyl-N-[(2,4,5-trimethylphenyl)methyl]acetamide
CID 115167183
2-methyl-2-[(2,4,5-trimethylphenyl)methylamino]propanoic acid
CID 115127969
2,2,2-trifluoro-N-[(2,4,5-trimethylphenyl)methyl]acetamide
CID 115190257
2-[4-(carboxymethyl)-2,5-dimethylphenyl]acetic acid
CID 658274
3-chloro-N-[(2,4,5-trimethylphenyl)methyl]propanamide
CID 115162512

Frequently Asked Questions

What is the IUPAC name of 2-(2,4,5-trimethylphenyl)acetohydrazide?
The IUPAC name of 2-(2,4,5-trimethylphenyl)acetohydrazide (CID 100523227) is 2-(2,4,5-trimethylphenyl)acetohydrazide.
What is the SMILES notation for 2-(2,4,5-trimethylphenyl)acetohydrazide?
The canonical SMILES for 2-(2,4,5-trimethylphenyl)acetohydrazide is Cc1cc(C)c(CC(=O)NN)cc1C.
What is the InChIKey of 2-(2,4,5-trimethylphenyl)acetohydrazide?
The InChIKey is XANBKTDYUASLRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-7-4-9(3)10(5-8(7)2)6-11(14)13-12/h4-5H,6,12H2,1-3H3,(H,13,14).
What are the key properties of 2-(2,4,5-trimethylphenyl)acetohydrazide?
2-(2,4,5-trimethylphenyl)acetohydrazide has a molecular weight of 192.26 g/mol, XLogP of 1.14, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4,5-trimethylphenyl)acetohydrazide is sourced from PubChem (CID 100523227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).