N-(2-hydrazinylethyl)prop-2-enamide

C5H11N3O — CID 151723314

IUPACN-(2-hydrazinylethyl)prop-2-enamide
SMILESC=CC(=O)NCCNN
InChIInChI=1S/C5H11N3O/c1-2-5(9)7-3-4-8-6/h2,8H,1,3-4,6H2,(H,7,9)
InChIKeyRJAUXEQKJIELAU-UHFFFAOYSA-N
MW129.16 g/mol
LogP-1.25
Rot. Bonds4

About N-(2-hydrazinylethyl)prop-2-enamide

N-(2-hydrazinylethyl)prop-2-enamide (PubChem CID 151723314) has the molecular formula C5H11N3O and a molecular weight of 129.16 g/mol. Its IUPAC name is N-(2-hydrazinylethyl)prop-2-enamide.

Molecular Properties

Compound NameN-(2-hydrazinylethyl)prop-2-enamide
PubChem CID151723314
Molecular FormulaC5H11N3O
Molecular Weight129.16 g/mol
Exact Mass129.09
IUPAC NameN-(2-hydrazinylethyl)prop-2-enamide
SMILESC=CC(=O)NCCNN
InChIInChI=1S/C5H11N3O/c1-2-5(9)7-3-4-8-6/h2,8H,1,3-4,6H2,(H,7,9)
InChIKeyRJAUXEQKJIELAU-UHFFFAOYSA-N
XLogP-1.25
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.16
LogP ≤ 5-1.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

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2-(Prop-2-enoylamino)ethylazanium
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N-piperazin-1-ylprop-2-enamide
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CID 58044780
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Frequently Asked Questions

What is the IUPAC name of N-(2-hydrazinylethyl)prop-2-enamide?
The IUPAC name of N-(2-hydrazinylethyl)prop-2-enamide (CID 151723314) is N-(2-hydrazinylethyl)prop-2-enamide.
What is the SMILES notation for N-(2-hydrazinylethyl)prop-2-enamide?
The canonical SMILES for N-(2-hydrazinylethyl)prop-2-enamide is C=CC(=O)NCCNN.
What is the InChIKey of N-(2-hydrazinylethyl)prop-2-enamide?
The InChIKey is RJAUXEQKJIELAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11N3O/c1-2-5(9)7-3-4-8-6/h2,8H,1,3-4,6H2,(H,7,9).
What are the key properties of N-(2-hydrazinylethyl)prop-2-enamide?
N-(2-hydrazinylethyl)prop-2-enamide has a molecular weight of 129.16 g/mol, XLogP of -1.25, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydrazinylethyl)prop-2-enamide is sourced from PubChem (CID 151723314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).