N'-acetyl-N-methyl-2-oxopropanehydrazide

C6H10N2O3 — CID 20646810

IUPACN'-acetyl-N-methyl-2-oxopropanehydrazide
SMILESCC(=O)NN(C)C(=O)C(C)=O
InChIInChI=1S/C6H10N2O3/c1-4(9)6(11)8(3)7-5(2)10/h1-3H3,(H,7,10)
InChIKeyWJEYTLXLXDDHGU-UHFFFAOYSA-N
MW158.16 g/mol
LogP-0.92
Rot. Bonds1

About N'-acetyl-N-methyl-2-oxopropanehydrazide

N'-acetyl-N-methyl-2-oxopropanehydrazide (PubChem CID 20646810) has the molecular formula C6H10N2O3 and a molecular weight of 158.16 g/mol. Its IUPAC name is N'-acetyl-N-methyl-2-oxopropanehydrazide.

Molecular Properties

Compound NameN'-acetyl-N-methyl-2-oxopropanehydrazide
PubChem CID20646810
Molecular FormulaC6H10N2O3
Molecular Weight158.16 g/mol
Exact Mass158.07
IUPAC NameN'-acetyl-N-methyl-2-oxopropanehydrazide
SMILESCC(=O)NN(C)C(=O)C(C)=O
InChIInChI=1S/C6H10N2O3/c1-4(9)6(11)8(3)7-5(2)10/h1-3H3,(H,7,10)
InChIKeyWJEYTLXLXDDHGU-UHFFFAOYSA-N
XLogP-0.92
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.16
LogP ≤ 5-0.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', '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'-acetyl-N-methyl-2-oxopropanehydrazide?
The IUPAC name of N'-acetyl-N-methyl-2-oxopropanehydrazide (CID 20646810) is N'-acetyl-N-methyl-2-oxopropanehydrazide.
What is the SMILES notation for N'-acetyl-N-methyl-2-oxopropanehydrazide?
The canonical SMILES for N'-acetyl-N-methyl-2-oxopropanehydrazide is CC(=O)NN(C)C(=O)C(C)=O.
What is the InChIKey of N'-acetyl-N-methyl-2-oxopropanehydrazide?
The InChIKey is WJEYTLXLXDDHGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O3/c1-4(9)6(11)8(3)7-5(2)10/h1-3H3,(H,7,10).
What are the key properties of N'-acetyl-N-methyl-2-oxopropanehydrazide?
N'-acetyl-N-methyl-2-oxopropanehydrazide has a molecular weight of 158.16 g/mol, XLogP of -0.92, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-acetyl-N-methyl-2-oxopropanehydrazide is sourced from PubChem (CID 20646810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).