2-(2-morpholin-4-ylethanehydrazonoyl)phenol

C12H17N3O2 — CID 139929802

IUPAC2-(2-morpholin-4-ylethanehydrazonoyl)phenol
SMILESN/N=C(\CN1CCOCC1)c1ccccc1O
InChIInChI=1S/C12H17N3O2/c13-14-11(9-15-5-7-17-8-6-15)10-3-1-2-4-12(10)16/h1-4,16H,5-9,13H2/b14-11+
InChIKeyDYTQXCRUSHOIRU-SDNWHVSQSA-N
MW235.29 g/mol
LogP0.39
Rot. Bonds3

About 2-(2-morpholin-4-ylethanehydrazonoyl)phenol

2-(2-morpholin-4-ylethanehydrazonoyl)phenol (PubChem CID 139929802) has the molecular formula C12H17N3O2 and a molecular weight of 235.29 g/mol. Its IUPAC name is 2-(2-morpholin-4-ylethanehydrazonoyl)phenol.

Molecular Properties

Compound Name2-(2-morpholin-4-ylethanehydrazonoyl)phenol
PubChem CID139929802
Molecular FormulaC12H17N3O2
Molecular Weight235.29 g/mol
Exact Mass235.13
IUPAC Name2-(2-morpholin-4-ylethanehydrazonoyl)phenol
SMILESN/N=C(\CN1CCOCC1)c1ccccc1O
InChIInChI=1S/C12H17N3O2/c13-14-11(9-15-5-7-17-8-6-15)10-3-1-2-4-12(10)16/h1-4,16H,5-9,13H2/b14-11+
InChIKeyDYTQXCRUSHOIRU-SDNWHVSQSA-N
XLogP0.39
TPSA71.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 50.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_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 2-(2-morpholin-4-ylethanehydrazonoyl)phenol?
The IUPAC name of 2-(2-morpholin-4-ylethanehydrazonoyl)phenol (CID 139929802) is 2-(2-morpholin-4-ylethanehydrazonoyl)phenol.
What is the SMILES notation for 2-(2-morpholin-4-ylethanehydrazonoyl)phenol?
The canonical SMILES for 2-(2-morpholin-4-ylethanehydrazonoyl)phenol is N/N=C(\CN1CCOCC1)c1ccccc1O.
What is the InChIKey of 2-(2-morpholin-4-ylethanehydrazonoyl)phenol?
The InChIKey is DYTQXCRUSHOIRU-SDNWHVSQSA-N. The full InChI is InChI=1S/C12H17N3O2/c13-14-11(9-15-5-7-17-8-6-15)10-3-1-2-4-12(10)16/h1-4,16H,5-9,13H2/b14-11+.
What are the key properties of 2-(2-morpholin-4-ylethanehydrazonoyl)phenol?
2-(2-morpholin-4-ylethanehydrazonoyl)phenol has a molecular weight of 235.29 g/mol, XLogP of 0.39, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-morpholin-4-ylethanehydrazonoyl)phenol is sourced from PubChem (CID 139929802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).