N-but-3-enyl-2-hydrazinylacetamide

C6H13N3O — CID 121448472

IUPACN-but-3-enyl-2-hydrazinylacetamide
SMILESC=CCCNC(=O)CNN
InChIInChI=1S/C6H13N3O/c1-2-3-4-8-6(10)5-9-7/h2,9H,1,3-5,7H2,(H,8,10)
InChIKeyDYWUVUNAJIOPPJ-UHFFFAOYSA-N
MW143.19 g/mol
LogP-0.86
Rot. Bonds5

About N-but-3-enyl-2-hydrazinylacetamide

N-but-3-enyl-2-hydrazinylacetamide (PubChem CID 121448472) has the molecular formula C6H13N3O and a molecular weight of 143.19 g/mol. Its IUPAC name is N-but-3-enyl-2-hydrazinylacetamide.

Molecular Properties

Compound NameN-but-3-enyl-2-hydrazinylacetamide
PubChem CID121448472
Molecular FormulaC6H13N3O
Molecular Weight143.19 g/mol
Exact Mass143.11
IUPAC NameN-but-3-enyl-2-hydrazinylacetamide
SMILESC=CCCNC(=O)CNN
InChIInChI=1S/C6H13N3O/c1-2-3-4-8-6(10)5-9-7/h2,9H,1,3-5,7H2,(H,8,10)
InChIKeyDYWUVUNAJIOPPJ-UHFFFAOYSA-N
XLogP-0.86
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 5-0.86
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': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(E)-N-(2-hydrazinyl-2-oxoethyl)pent-3-enamide
CID 5901218
2-hydrazinyl-2-oxo-N-(prop-2-en-1-yl)acetamide
CID 5150832
2-amino-N-but-3-enylacetamide
CID 23501168
2-hydrazinyl-N-prop-2-enylacetamide
CID 83694224
N-(2-hydrazinyl-2-oxoethyl)pent-3-enamide
CID 2729299

Frequently Asked Questions

What is the IUPAC name of N-but-3-enyl-2-hydrazinylacetamide?
The IUPAC name of N-but-3-enyl-2-hydrazinylacetamide (CID 121448472) is N-but-3-enyl-2-hydrazinylacetamide.
What is the SMILES notation for N-but-3-enyl-2-hydrazinylacetamide?
The canonical SMILES for N-but-3-enyl-2-hydrazinylacetamide is C=CCCNC(=O)CNN.
What is the InChIKey of N-but-3-enyl-2-hydrazinylacetamide?
The InChIKey is DYWUVUNAJIOPPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N3O/c1-2-3-4-8-6(10)5-9-7/h2,9H,1,3-5,7H2,(H,8,10).
What are the key properties of N-but-3-enyl-2-hydrazinylacetamide?
N-but-3-enyl-2-hydrazinylacetamide has a molecular weight of 143.19 g/mol, XLogP of -0.86, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-but-3-enyl-2-hydrazinylacetamide is sourced from PubChem (CID 121448472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).