2-(2-hydroperoxyhydrazinyl)butanamide

C4H11N3O3 — CID 134533270

IUPAC2-(2-hydroperoxyhydrazinyl)butanamide
SMILESCCC(NNOO)C(N)=O
InChIInChI=1S/C4H11N3O3/c1-2-3(4(5)8)6-7-10-9/h3,6-7,9H,2H2,1H3,(H2,5,8)
InChIKeyDNGMFYFBOPZGKT-UHFFFAOYSA-N
MW149.15 g/mol
LogP-1.25
Rot. Bonds5

About 2-(2-hydroperoxyhydrazinyl)butanamide

2-(2-hydroperoxyhydrazinyl)butanamide (PubChem CID 134533270) has the molecular formula C4H11N3O3 and a molecular weight of 149.15 g/mol. Its IUPAC name is 2-(2-hydroperoxyhydrazinyl)butanamide.

Molecular Properties

Compound Name2-(2-hydroperoxyhydrazinyl)butanamide
PubChem CID134533270
Molecular FormulaC4H11N3O3
Molecular Weight149.15 g/mol
Exact Mass149.08
IUPAC Name2-(2-hydroperoxyhydrazinyl)butanamide
SMILESCCC(NNOO)C(N)=O
InChIInChI=1S/C4H11N3O3/c1-2-3(4(5)8)6-7-10-9/h3,6-7,9H,2H2,1H3,(H2,5,8)
InChIKeyDNGMFYFBOPZGKT-UHFFFAOYSA-N
XLogP-1.25
TPSA96.61 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.15
LogP ≤ 5-1.25
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-[(1-amino-1-oxobutan-2-yl)amino]butanamide
CID 174420695
2-(pentan-3-ylamino)butanamide
CID 62899455
2-formamidobutanamide
CID 55291106
2-(2-aminoethylamino)butanamide
CID 62900229
2-(butylamino)butanamide
CID 62901736
methyl 2-[(1-amino-1-oxobutan-2-yl)amino]-4-methylpentanoate
CID 62901379
2-[(4-ethylcyclohexyl)methylamino]butanamide
CID 62901748
3-[(1-amino-1-oxobutan-2-yl)amino]-2,2-dimethylpropanamide
CID 106276342
N-[(2S)-1-amino-1-oxobutan-2-yl]pentanamide
CID 88957287
methane;2-methylbutanamide
CID 158835184
(2R)-2-(4-hydroxybutanoylamino)butanamide
CID 167531373
2-(4-methoxyanilino)butanamide
CID 61005469

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroperoxyhydrazinyl)butanamide?
The IUPAC name of 2-(2-hydroperoxyhydrazinyl)butanamide (CID 134533270) is 2-(2-hydroperoxyhydrazinyl)butanamide.
What is the SMILES notation for 2-(2-hydroperoxyhydrazinyl)butanamide?
The canonical SMILES for 2-(2-hydroperoxyhydrazinyl)butanamide is CCC(NNOO)C(N)=O.
What is the InChIKey of 2-(2-hydroperoxyhydrazinyl)butanamide?
The InChIKey is DNGMFYFBOPZGKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11N3O3/c1-2-3(4(5)8)6-7-10-9/h3,6-7,9H,2H2,1H3,(H2,5,8).
What are the key properties of 2-(2-hydroperoxyhydrazinyl)butanamide?
2-(2-hydroperoxyhydrazinyl)butanamide has a molecular weight of 149.15 g/mol, XLogP of -1.25, 5 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroperoxyhydrazinyl)butanamide is sourced from PubChem (CID 134533270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).