2-(2,5-dimethylphenyl)-N-methylacetohydrazide

C11H16N2O — CID 116844756

IUPAC2-(2,5-dimethylphenyl)-N-methylacetohydrazide
SMILESCc1ccc(C)c(CC(=O)N(C)N)c1
InChIInChI=1S/C11H16N2O/c1-8-4-5-9(2)10(6-8)7-11(14)13(3)12/h4-6H,7,12H2,1-3H3
InChIKeyLYOKFEYCHNJHST-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.18
Rot. Bonds2

About 2-(2,5-dimethylphenyl)-N-methylacetohydrazide

2-(2,5-dimethylphenyl)-N-methylacetohydrazide (PubChem CID 116844756) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 2-(2,5-dimethylphenyl)-N-methylacetohydrazide.

Molecular Properties

Compound Name2-(2,5-dimethylphenyl)-N-methylacetohydrazide
PubChem CID116844756
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name2-(2,5-dimethylphenyl)-N-methylacetohydrazide
SMILESCc1ccc(C)c(CC(=O)N(C)N)c1
InChIInChI=1S/C11H16N2O/c1-8-4-5-9(2)10(6-8)7-11(14)13(3)12/h4-6H,7,12H2,1-3H3
InChIKeyLYOKFEYCHNJHST-UHFFFAOYSA-N
XLogP1.18
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.18
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-[[2-(2,5-dimethylphenyl)acetyl]-methylamino]acetic acid
CID 62538496
N-(1-aminopropan-2-yl)-2-(2,5-dimethylphenyl)-N-methylacetamide;hydrochloride
CID 119584413
2-(2,5-dimethylphenyl)-N-(1-hydroxypropan-2-yl)-N-methylacetamide
CID 112704730
2-(2,5-dimethylphenyl)-N-(4-hydroxyphenyl)-N-methylacetamide
CID 62539015
N-(5-aminopentyl)-2-(2,5-dimethylphenyl)-N-methylacetamide
CID 107206649
N-(4-cyanophenyl)-2-(2,5-dimethylphenyl)-N-methylacetamide
CID 62981903
N-(2-bromopropyl)-2-(2,5-dimethylphenyl)-N-methylacetamide
CID 80666132
2-[[2-(2,5-dimethylphenyl)acetyl]-methylamino]butanoic acid
CID 55086579
N-(3-amino-3-sulfanylidenepropyl)-2-(2,5-dimethylphenyl)-N-propan-2-ylacetamide
CID 62538513
N-[3-(aminomethyl)phenyl]-2-(2,5-dimethylphenyl)-N-methylacetamide
CID 62971832
2-(2,5-dimethylphenyl)-N-(3-hydroxyphenyl)-N-methylacetamide
CID 107735699
5-(2,4-dimethylphenyl)-N-methylpentanehydrazide
CID 116845214

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylphenyl)-N-methylacetohydrazide?
The IUPAC name of 2-(2,5-dimethylphenyl)-N-methylacetohydrazide (CID 116844756) is 2-(2,5-dimethylphenyl)-N-methylacetohydrazide.
What is the SMILES notation for 2-(2,5-dimethylphenyl)-N-methylacetohydrazide?
The canonical SMILES for 2-(2,5-dimethylphenyl)-N-methylacetohydrazide is Cc1ccc(C)c(CC(=O)N(C)N)c1.
What is the InChIKey of 2-(2,5-dimethylphenyl)-N-methylacetohydrazide?
The InChIKey is LYOKFEYCHNJHST-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-8-4-5-9(2)10(6-8)7-11(14)13(3)12/h4-6H,7,12H2,1-3H3.
What are the key properties of 2-(2,5-dimethylphenyl)-N-methylacetohydrazide?
2-(2,5-dimethylphenyl)-N-methylacetohydrazide has a molecular weight of 192.26 g/mol, XLogP of 1.18, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylphenyl)-N-methylacetohydrazide is sourced from PubChem (CID 116844756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).