(E)-4-morpholin-4-ylbut-2-enehydrazide

C8H15N3O2 — CID 144832692

IUPAC(E)-4-morpholin-4-ylbut-2-enehydrazide
SMILESNNC(=O)/C=C/CN1CCOCC1
InChIInChI=1S/C8H15N3O2/c9-10-8(12)2-1-3-11-4-6-13-7-5-11/h1-2H,3-7,9H2,(H,10,12)/b2-1+
InChIKeyLVOJCEAFOGNICT-OWOJBTEDSA-N
MW185.23 g/mol
LogP-1.14
Rot. Bonds3

About (E)-4-morpholin-4-ylbut-2-enehydrazide

(E)-4-morpholin-4-ylbut-2-enehydrazide (PubChem CID 144832692) has the molecular formula C8H15N3O2 and a molecular weight of 185.23 g/mol. Its IUPAC name is (E)-4-morpholin-4-ylbut-2-enehydrazide.

Molecular Properties

Compound Name(E)-4-morpholin-4-ylbut-2-enehydrazide
PubChem CID144832692
Molecular FormulaC8H15N3O2
Molecular Weight185.23 g/mol
Exact Mass185.12
IUPAC Name(E)-4-morpholin-4-ylbut-2-enehydrazide
SMILESNNC(=O)/C=C/CN1CCOCC1
InChIInChI=1S/C8H15N3O2/c9-10-8(12)2-1-3-11-4-6-13-7-5-11/h1-2H,3-7,9H2,(H,10,12)/b2-1+
InChIKeyLVOJCEAFOGNICT-OWOJBTEDSA-N
XLogP-1.14
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.23
LogP ≤ 5-1.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', '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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Frequently Asked Questions

What is the IUPAC name of (E)-4-morpholin-4-ylbut-2-enehydrazide?
The IUPAC name of (E)-4-morpholin-4-ylbut-2-enehydrazide (CID 144832692) is (E)-4-morpholin-4-ylbut-2-enehydrazide.
What is the SMILES notation for (E)-4-morpholin-4-ylbut-2-enehydrazide?
The canonical SMILES for (E)-4-morpholin-4-ylbut-2-enehydrazide is NNC(=O)/C=C/CN1CCOCC1.
What is the InChIKey of (E)-4-morpholin-4-ylbut-2-enehydrazide?
The InChIKey is LVOJCEAFOGNICT-OWOJBTEDSA-N. The full InChI is InChI=1S/C8H15N3O2/c9-10-8(12)2-1-3-11-4-6-13-7-5-11/h1-2H,3-7,9H2,(H,10,12)/b2-1+.
What are the key properties of (E)-4-morpholin-4-ylbut-2-enehydrazide?
(E)-4-morpholin-4-ylbut-2-enehydrazide has a molecular weight of 185.23 g/mol, XLogP of -1.14, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-4-morpholin-4-ylbut-2-enehydrazide is sourced from PubChem (CID 144832692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).