3-(2-methylhydrazinyl)propanamide

C4H11N3O — CID 88881479

IUPAC3-(2-methylhydrazinyl)propanamide
SMILESCNNCCC(N)=O
InChIInChI=1S/C4H11N3O/c1-6-7-3-2-4(5)8/h6-7H,2-3H2,1H3,(H2,5,8)
InChIKeyOHGQIJAAECEYCV-UHFFFAOYSA-N
MW117.15 g/mol
LogP-1.41
Rot. Bonds4

About 3-(2-methylhydrazinyl)propanamide

3-(2-methylhydrazinyl)propanamide (PubChem CID 88881479) has the molecular formula C4H11N3O and a molecular weight of 117.15 g/mol. Its IUPAC name is 3-(2-methylhydrazinyl)propanamide.

Molecular Properties

Compound Name3-(2-methylhydrazinyl)propanamide
PubChem CID88881479
Molecular FormulaC4H11N3O
Molecular Weight117.15 g/mol
Exact Mass117.09
IUPAC Name3-(2-methylhydrazinyl)propanamide
SMILESCNNCCC(N)=O
InChIInChI=1S/C4H11N3O/c1-6-7-3-2-4(5)8/h6-7H,2-3H2,1H3,(H2,5,8)
InChIKeyOHGQIJAAECEYCV-UHFFFAOYSA-N
XLogP-1.41
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.15
LogP ≤ 5-1.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', '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 3-(2-methylhydrazinyl)propanamide?
The IUPAC name of 3-(2-methylhydrazinyl)propanamide (CID 88881479) is 3-(2-methylhydrazinyl)propanamide.
What is the SMILES notation for 3-(2-methylhydrazinyl)propanamide?
The canonical SMILES for 3-(2-methylhydrazinyl)propanamide is CNNCCC(N)=O.
What is the InChIKey of 3-(2-methylhydrazinyl)propanamide?
The InChIKey is OHGQIJAAECEYCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11N3O/c1-6-7-3-2-4(5)8/h6-7H,2-3H2,1H3,(H2,5,8).
What are the key properties of 3-(2-methylhydrazinyl)propanamide?
3-(2-methylhydrazinyl)propanamide has a molecular weight of 117.15 g/mol, XLogP of -1.41, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylhydrazinyl)propanamide is sourced from PubChem (CID 88881479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).