2-[(1-hydrazinyl-3-methyl-1-oxobutan-2-yl)-methylamino]acetamide

C8H18N4O2 — CID 63573846

IUPAC2-[(1-hydrazinyl-3-methyl-1-oxobutan-2-yl)-methylamino]acetamide
SMILESCC(C)C(C(=O)NN)N(C)CC(N)=O
InChIInChI=1S/C8H18N4O2/c1-5(2)7(8(14)11-10)12(3)4-6(9)13/h5,7H,4,10H2,1-3H3,(H2,9,13)(H,11,14)
InChIKeyCLOXPVQCFYFOTE-UHFFFAOYSA-N
MW202.26 g/mol
LogP-1.58
Rot. Bonds5

About 2-[(1-hydrazinyl-3-methyl-1-oxobutan-2-yl)-methylamino]acetamide

2-[(1-hydrazinyl-3-methyl-1-oxobutan-2-yl)-methylamino]acetamide (PubChem CID 63573846) has the molecular formula C8H18N4O2 and a molecular weight of 202.26 g/mol. Its IUPAC name is 2-[(1-hydrazinyl-3-methyl-1-oxobutan-2-yl)-methylamino]acetamide.

Molecular Properties

Compound Name2-[(1-hydrazinyl-3-methyl-1-oxobutan-2-yl)-methylamino]acetamide
PubChem CID63573846
Molecular FormulaC8H18N4O2
Molecular Weight202.26 g/mol
Exact Mass202.14
IUPAC Name2-[(1-hydrazinyl-3-methyl-1-oxobutan-2-yl)-methylamino]acetamide
SMILESCC(C)C(C(=O)NN)N(C)CC(N)=O
InChIInChI=1S/C8H18N4O2/c1-5(2)7(8(14)11-10)12(3)4-6(9)13/h5,7H,4,10H2,1-3H3,(H2,9,13)(H,11,14)
InChIKeyCLOXPVQCFYFOTE-UHFFFAOYSA-N
XLogP-1.58
TPSA101.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 5-1.58
H-Bond Donors ≤ 53
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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Frequently Asked Questions

What is the IUPAC name of 2-[(1-hydrazinyl-3-methyl-1-oxobutan-2-yl)-methylamino]acetamide?
The IUPAC name of 2-[(1-hydrazinyl-3-methyl-1-oxobutan-2-yl)-methylamino]acetamide (CID 63573846) is 2-[(1-hydrazinyl-3-methyl-1-oxobutan-2-yl)-methylamino]acetamide.
What is the SMILES notation for 2-[(1-hydrazinyl-3-methyl-1-oxobutan-2-yl)-methylamino]acetamide?
The canonical SMILES for 2-[(1-hydrazinyl-3-methyl-1-oxobutan-2-yl)-methylamino]acetamide is CC(C)C(C(=O)NN)N(C)CC(N)=O.
What is the InChIKey of 2-[(1-hydrazinyl-3-methyl-1-oxobutan-2-yl)-methylamino]acetamide?
The InChIKey is CLOXPVQCFYFOTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N4O2/c1-5(2)7(8(14)11-10)12(3)4-6(9)13/h5,7H,4,10H2,1-3H3,(H2,9,13)(H,11,14).
What are the key properties of 2-[(1-hydrazinyl-3-methyl-1-oxobutan-2-yl)-methylamino]acetamide?
2-[(1-hydrazinyl-3-methyl-1-oxobutan-2-yl)-methylamino]acetamide has a molecular weight of 202.26 g/mol, XLogP of -1.58, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-hydrazinyl-3-methyl-1-oxobutan-2-yl)-methylamino]acetamide is sourced from PubChem (CID 63573846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).