N,N'-dimethyl-N'-(2-oxoethyl)acetohydrazide

C6H12N2O2 — CID 174398754

IUPACN,N'-dimethyl-N'-(2-oxoethyl)acetohydrazide
SMILESCC(=O)N(C)N(C)CC=O
InChIInChI=1S/C6H12N2O2/c1-6(10)8(3)7(2)4-5-9/h5H,4H2,1-3H3
InChIKeyBENRFWZTWFKCHG-UHFFFAOYSA-N
MW144.17 g/mol
LogP-0.49
Rot. Bonds3

About N,N'-dimethyl-N'-(2-oxoethyl)acetohydrazide

N,N'-dimethyl-N'-(2-oxoethyl)acetohydrazide (PubChem CID 174398754) has the molecular formula C6H12N2O2 and a molecular weight of 144.17 g/mol. Its IUPAC name is N,N'-dimethyl-N'-(2-oxoethyl)acetohydrazide.

Molecular Properties

Compound NameN,N'-dimethyl-N'-(2-oxoethyl)acetohydrazide
PubChem CID174398754
Molecular FormulaC6H12N2O2
Molecular Weight144.17 g/mol
Exact Mass144.09
IUPAC NameN,N'-dimethyl-N'-(2-oxoethyl)acetohydrazide
SMILESCC(=O)N(C)N(C)CC=O
InChIInChI=1S/C6H12N2O2/c1-6(10)8(3)7(2)4-5-9/h5H,4H2,1-3H3
InChIKeyBENRFWZTWFKCHG-UHFFFAOYSA-N
XLogP-0.49
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.17
LogP ≤ 5-0.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,N'-dimethyl-N'-(2-oxoethyl)acetohydrazide?
The IUPAC name of N,N'-dimethyl-N'-(2-oxoethyl)acetohydrazide (CID 174398754) is N,N'-dimethyl-N'-(2-oxoethyl)acetohydrazide.
What is the SMILES notation for N,N'-dimethyl-N'-(2-oxoethyl)acetohydrazide?
The canonical SMILES for N,N'-dimethyl-N'-(2-oxoethyl)acetohydrazide is CC(=O)N(C)N(C)CC=O.
What is the InChIKey of N,N'-dimethyl-N'-(2-oxoethyl)acetohydrazide?
The InChIKey is BENRFWZTWFKCHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O2/c1-6(10)8(3)7(2)4-5-9/h5H,4H2,1-3H3.
What are the key properties of N,N'-dimethyl-N'-(2-oxoethyl)acetohydrazide?
N,N'-dimethyl-N'-(2-oxoethyl)acetohydrazide has a molecular weight of 144.17 g/mol, XLogP of -0.49, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-dimethyl-N'-(2-oxoethyl)acetohydrazide is sourced from PubChem (CID 174398754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).