N-[1-amino-3-(2-methylhydrazinyl)-1-oxopropan-2-yl]-2,2-dimethylpropanamide

C9H20N4O2 — CID 59817353

IUPACN-[1-amino-3-(2-methylhydrazinyl)-1-oxopropan-2-yl]-2,2-dimethylpropanamide
SMILESCNNCC(NC(=O)C(C)(C)C)C(N)=O
InChIInChI=1S/C9H20N4O2/c1-9(2,3)8(15)13-6(7(10)14)5-12-11-4/h6,11-12H,5H2,1-4H3,(H2,10,14)(H,13,15)
InChIKeyGYCFPJFHKQAESS-UHFFFAOYSA-N
MW216.28 g/mol
LogP-1.27
Rot. Bonds5

About N-[1-amino-3-(2-methylhydrazinyl)-1-oxopropan-2-yl]-2,2-dimethylpropanamide

N-[1-amino-3-(2-methylhydrazinyl)-1-oxopropan-2-yl]-2,2-dimethylpropanamide (PubChem CID 59817353) has the molecular formula C9H20N4O2 and a molecular weight of 216.28 g/mol. Its IUPAC name is N-[1-amino-3-(2-methylhydrazinyl)-1-oxopropan-2-yl]-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-[1-amino-3-(2-methylhydrazinyl)-1-oxopropan-2-yl]-2,2-dimethylpropanamide
PubChem CID59817353
Molecular FormulaC9H20N4O2
Molecular Weight216.28 g/mol
Exact Mass216.16
IUPAC NameN-[1-amino-3-(2-methylhydrazinyl)-1-oxopropan-2-yl]-2,2-dimethylpropanamide
SMILESCNNCC(NC(=O)C(C)(C)C)C(N)=O
InChIInChI=1S/C9H20N4O2/c1-9(2,3)8(15)13-6(7(10)14)5-12-11-4/h6,11-12H,5H2,1-4H3,(H2,10,14)(H,13,15)
InChIKeyGYCFPJFHKQAESS-UHFFFAOYSA-N
XLogP-1.27
TPSA96.25 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 5-1.27
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[1-amino-3-(2-methylhydrazinyl)-1-oxopropan-2-yl]-2,2-dimethylpropanamide?
The IUPAC name of N-[1-amino-3-(2-methylhydrazinyl)-1-oxopropan-2-yl]-2,2-dimethylpropanamide (CID 59817353) is N-[1-amino-3-(2-methylhydrazinyl)-1-oxopropan-2-yl]-2,2-dimethylpropanamide.
What is the SMILES notation for N-[1-amino-3-(2-methylhydrazinyl)-1-oxopropan-2-yl]-2,2-dimethylpropanamide?
The canonical SMILES for N-[1-amino-3-(2-methylhydrazinyl)-1-oxopropan-2-yl]-2,2-dimethylpropanamide is CNNCC(NC(=O)C(C)(C)C)C(N)=O.
What is the InChIKey of N-[1-amino-3-(2-methylhydrazinyl)-1-oxopropan-2-yl]-2,2-dimethylpropanamide?
The InChIKey is GYCFPJFHKQAESS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N4O2/c1-9(2,3)8(15)13-6(7(10)14)5-12-11-4/h6,11-12H,5H2,1-4H3,(H2,10,14)(H,13,15).
What are the key properties of N-[1-amino-3-(2-methylhydrazinyl)-1-oxopropan-2-yl]-2,2-dimethylpropanamide?
N-[1-amino-3-(2-methylhydrazinyl)-1-oxopropan-2-yl]-2,2-dimethylpropanamide has a molecular weight of 216.28 g/mol, XLogP of -1.27, 5 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-amino-3-(2-methylhydrazinyl)-1-oxopropan-2-yl]-2,2-dimethylpropanamide is sourced from PubChem (CID 59817353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).