N',N'-diacetylacetohydrazide

C6H10N2O3 — CID 13230474

IUPACN',N'-diacetylacetohydrazide
SMILESCC(=O)NN(C(C)=O)C(C)=O
InChIInChI=1S/C6H10N2O3/c1-4(9)7-8(5(2)10)6(3)11/h1-3H3,(H,7,9)
InChIKeyVWBVKMSHZUUXKH-UHFFFAOYSA-N
MW158.16 g/mol
LogP-0.57
Rot. Bonds

About N',N'-diacetylacetohydrazide

N',N'-diacetylacetohydrazide (PubChem CID 13230474) has the molecular formula C6H10N2O3 and a molecular weight of 158.16 g/mol. Its IUPAC name is N',N'-diacetylacetohydrazide.

Molecular Properties

Compound NameN',N'-diacetylacetohydrazide
PubChem CID13230474
Molecular FormulaC6H10N2O3
Molecular Weight158.16 g/mol
Exact Mass158.07
IUPAC NameN',N'-diacetylacetohydrazide
SMILESCC(=O)NN(C(C)=O)C(C)=O
InChIInChI=1S/C6H10N2O3/c1-4(9)7-8(5(2)10)6(3)11/h1-3H3,(H,7,9)
InChIKeyVWBVKMSHZUUXKH-UHFFFAOYSA-N
XLogP-0.57
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.16
LogP ≤ 5-0.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N'-acetyl-N'-propan-2-ylacetohydrazide
CID 90431955
N'-acetyl-N'-butan-2-ylacetohydrazide
CID 170007256
(diacetylamino)-λ2-stannane
CID 174584376
N'-acetyl-N'-butylacetohydrazide
CID 141194485
acetamido(acetyl)sulfamic acid;N,N-diethylethanamine
CID 175118779
N-methyliodanuidylacetamide
CID 147139954
N'-acetyl-N'-benzylacetohydrazide
CID 23198251
tris(N-acetylacetamide);gallane
CID 175572719
bis(N-methylacetamide);propan-2-one
CID 158104043
acetohydrazide
CID 169432654
CID 159040973
CID 159040973
azane;N,N-dimethylacetamide
CID 161145572

Frequently Asked Questions

What is the IUPAC name of N',N'-diacetylacetohydrazide?
The IUPAC name of N',N'-diacetylacetohydrazide (CID 13230474) is N',N'-diacetylacetohydrazide.
What is the SMILES notation for N',N'-diacetylacetohydrazide?
The canonical SMILES for N',N'-diacetylacetohydrazide is CC(=O)NN(C(C)=O)C(C)=O.
What is the InChIKey of N',N'-diacetylacetohydrazide?
The InChIKey is VWBVKMSHZUUXKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O3/c1-4(9)7-8(5(2)10)6(3)11/h1-3H3,(H,7,9).
What are the key properties of N',N'-diacetylacetohydrazide?
N',N'-diacetylacetohydrazide has a molecular weight of 158.16 g/mol, XLogP of -0.57, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-diacetylacetohydrazide is sourced from PubChem (CID 13230474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).