2-hydrazinyl-N-(3-morpholin-4-ylpropyl)-2-oxoacetamide

C9H18N4O3 — CID 3127476

IUPAC2-hydrazinyl-N-(3-morpholin-4-ylpropyl)-2-oxoacetamide
SMILESNNC(=O)C(=O)NCCCN1CCOCC1
InChIInChI=1S/C9H18N4O3/c10-12-9(15)8(14)11-2-1-3-13-4-6-16-7-5-13/h1-7,10H2,(H,11,14)(H,12,15)
InChIKeyIBGLJUXHUWFQJV-UHFFFAOYSA-N
MW230.27 g/mol
LogP-2.19
Rot. Bonds4

About 2-hydrazinyl-N-(3-morpholin-4-ylpropyl)-2-oxoacetamide

2-hydrazinyl-N-(3-morpholin-4-ylpropyl)-2-oxoacetamide (PubChem CID 3127476) has the molecular formula C9H18N4O3 and a molecular weight of 230.27 g/mol. Its IUPAC name is 2-hydrazinyl-N-(3-morpholin-4-ylpropyl)-2-oxoacetamide.

Molecular Properties

Compound Name2-hydrazinyl-N-(3-morpholin-4-ylpropyl)-2-oxoacetamide
PubChem CID3127476
Molecular FormulaC9H18N4O3
Molecular Weight230.27 g/mol
Exact Mass230.14
IUPAC Name2-hydrazinyl-N-(3-morpholin-4-ylpropyl)-2-oxoacetamide
SMILESNNC(=O)C(=O)NCCCN1CCOCC1
InChIInChI=1S/C9H18N4O3/c10-12-9(15)8(14)11-2-1-3-13-4-6-16-7-5-13/h1-7,10H2,(H,11,14)(H,12,15)
InChIKeyIBGLJUXHUWFQJV-UHFFFAOYSA-N
XLogP-2.19
TPSA96.69 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 5-2.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'diketo_group', '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-hydrazinyl-N-(3-morpholin-4-ylpropyl)-2-oxoacetamide?
The IUPAC name of 2-hydrazinyl-N-(3-morpholin-4-ylpropyl)-2-oxoacetamide (CID 3127476) is 2-hydrazinyl-N-(3-morpholin-4-ylpropyl)-2-oxoacetamide.
What is the SMILES notation for 2-hydrazinyl-N-(3-morpholin-4-ylpropyl)-2-oxoacetamide?
The canonical SMILES for 2-hydrazinyl-N-(3-morpholin-4-ylpropyl)-2-oxoacetamide is NNC(=O)C(=O)NCCCN1CCOCC1.
What is the InChIKey of 2-hydrazinyl-N-(3-morpholin-4-ylpropyl)-2-oxoacetamide?
The InChIKey is IBGLJUXHUWFQJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N4O3/c10-12-9(15)8(14)11-2-1-3-13-4-6-16-7-5-13/h1-7,10H2,(H,11,14)(H,12,15).
What are the key properties of 2-hydrazinyl-N-(3-morpholin-4-ylpropyl)-2-oxoacetamide?
2-hydrazinyl-N-(3-morpholin-4-ylpropyl)-2-oxoacetamide has a molecular weight of 230.27 g/mol, XLogP of -2.19, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-N-(3-morpholin-4-ylpropyl)-2-oxoacetamide is sourced from PubChem (CID 3127476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).