2-(2,4-dimethyl-1,3-dioxolan-2-yl)acetohydrazide

C7H14N2O3 — CID 4203891

IUPAC2-(2,4-dimethyl-1,3-dioxolan-2-yl)acetohydrazide
SMILESCC1COC(C)(CC(=O)NN)O1
InChIInChI=1S/C7H14N2O3/c1-5-4-11-7(2,12-5)3-6(10)9-8/h5H,3-4,8H2,1-2H3,(H,9,10)
InChIKeyQKGCZHRFGAFLBK-UHFFFAOYSA-N
MW174.20 g/mol
LogP-0.48
Rot. Bonds2

About 2-(2,4-dimethyl-1,3-dioxolan-2-yl)acetohydrazide

2-(2,4-dimethyl-1,3-dioxolan-2-yl)acetohydrazide (PubChem CID 4203891) has the molecular formula C7H14N2O3 and a molecular weight of 174.20 g/mol. Its IUPAC name is 2-(2,4-dimethyl-1,3-dioxolan-2-yl)acetohydrazide.

Molecular Properties

Compound Name2-(2,4-dimethyl-1,3-dioxolan-2-yl)acetohydrazide
PubChem CID4203891
Molecular FormulaC7H14N2O3
Molecular Weight174.20 g/mol
Exact Mass174.10
IUPAC Name2-(2,4-dimethyl-1,3-dioxolan-2-yl)acetohydrazide
SMILESCC1COC(C)(CC(=O)NN)O1
InChIInChI=1S/C7H14N2O3/c1-5-4-11-7(2,12-5)3-6(10)9-8/h5H,3-4,8H2,1-2H3,(H,9,10)
InChIKeyQKGCZHRFGAFLBK-UHFFFAOYSA-N
XLogP-0.48
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.20
LogP ≤ 5-0.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

6-(2,4-dimethyl-1,3-dioxolan-2-yl)hexanoic acid
CID 174901401
2-(1-methylcyclohexyl)acetohydrazide
CID 131019912
2,4-dimethyl-1,3-dioxolane-2-carboxylic acid;hydrofluoride
CID 146547924
1-(2,4-dimethyl-1,3-dioxolan-2-yl)propan-1-one
CID 175532850
methyl 2-(2,5-dimethyl-1,3-dioxan-2-yl)acetate
CID 143088707
[(2S,3R,5S,6R)-2,3,4,5,6-pentakis[[2-(2,4-dimethyl-1,3-dioxan-2-yl)acetyl]oxy]cyclohexyl] 2-(2,6-dimethyl-1,4-dioxan-2-yl)acetate
CID 176585526
2-(2-methyl-1,3-dithian-2-yl)acetohydrazide
CID 134121241
methyl 2-(5-hydroxy-2-methyl-1,3-dioxan-2-yl)acetate
CID 130129881
2-(3,5-dimethylmorpholin-4-yl)acetohydrazide
CID 86703014
bis[(2-ethyl-2-methyl-1,3-dioxolan-4-yl)methyl] butanedioate
CID 139293602
sulfamoyl chloride;2,2,4-trimethyl-1,3-dioxolane
CID 87571306
8-amino-3-methyl-1,4-dioxaspiro[4.5]decane-8-carboxylic acid
CID 67379021

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethyl-1,3-dioxolan-2-yl)acetohydrazide?
The IUPAC name of 2-(2,4-dimethyl-1,3-dioxolan-2-yl)acetohydrazide (CID 4203891) is 2-(2,4-dimethyl-1,3-dioxolan-2-yl)acetohydrazide.
What is the SMILES notation for 2-(2,4-dimethyl-1,3-dioxolan-2-yl)acetohydrazide?
The canonical SMILES for 2-(2,4-dimethyl-1,3-dioxolan-2-yl)acetohydrazide is CC1COC(C)(CC(=O)NN)O1.
What is the InChIKey of 2-(2,4-dimethyl-1,3-dioxolan-2-yl)acetohydrazide?
The InChIKey is QKGCZHRFGAFLBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O3/c1-5-4-11-7(2,12-5)3-6(10)9-8/h5H,3-4,8H2,1-2H3,(H,9,10).
What are the key properties of 2-(2,4-dimethyl-1,3-dioxolan-2-yl)acetohydrazide?
2-(2,4-dimethyl-1,3-dioxolan-2-yl)acetohydrazide has a molecular weight of 174.20 g/mol, XLogP of -0.48, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethyl-1,3-dioxolan-2-yl)acetohydrazide is sourced from PubChem (CID 4203891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).