1-(4-hydrazinylphenyl)-N-(2-morpholin-4-ylethoxy)methanimine;hydrochloride

C13H21ClN4O2 — CID 87290774

IUPAC1-(4-hydrazinylphenyl)-N-(2-morpholin-4-ylethoxy)methanimine;hydrochloride
SMILESCl.NNc1ccc(C=NOCCN2CCOCC2)cc1
InChIInChI=1S/C13H20N4O2.ClH/c14-16-13-3-1-12(2-4-13)11-15-19-10-7-17-5-8-18-9-6-17;/h1-4,11,16H,5-10,14H2;1H
InChIKeyRQBFUJOBTUNMGQ-UHFFFAOYSA-N
MW300.79 g/mol
LogP1.08
Rot. Bonds6

About 1-(4-hydrazinylphenyl)-N-(2-morpholin-4-ylethoxy)methanimine;hydrochloride

1-(4-hydrazinylphenyl)-N-(2-morpholin-4-ylethoxy)methanimine;hydrochloride (PubChem CID 87290774) has the molecular formula C13H21ClN4O2 and a molecular weight of 300.79 g/mol. Its IUPAC name is 1-(4-hydrazinylphenyl)-N-(2-morpholin-4-ylethoxy)methanimine;hydrochloride.

Molecular Properties

Compound Name1-(4-hydrazinylphenyl)-N-(2-morpholin-4-ylethoxy)methanimine;hydrochloride
PubChem CID87290774
Molecular FormulaC13H21ClN4O2
Molecular Weight300.79 g/mol
Exact Mass300.14
IUPAC Name1-(4-hydrazinylphenyl)-N-(2-morpholin-4-ylethoxy)methanimine;hydrochloride
SMILESCl.NNc1ccc(C=NOCCN2CCOCC2)cc1
InChIInChI=1S/C13H20N4O2.ClH/c14-16-13-3-1-12(2-4-13)11-15-19-10-7-17-5-8-18-9-6-17;/h1-4,11,16H,5-10,14H2;1H
InChIKeyRQBFUJOBTUNMGQ-UHFFFAOYSA-N
XLogP1.08
TPSA72.11 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.79
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', '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 1-(4-hydrazinylphenyl)-N-(2-morpholin-4-ylethoxy)methanimine;hydrochloride?
The IUPAC name of 1-(4-hydrazinylphenyl)-N-(2-morpholin-4-ylethoxy)methanimine;hydrochloride (CID 87290774) is 1-(4-hydrazinylphenyl)-N-(2-morpholin-4-ylethoxy)methanimine;hydrochloride.
What is the SMILES notation for 1-(4-hydrazinylphenyl)-N-(2-morpholin-4-ylethoxy)methanimine;hydrochloride?
The canonical SMILES for 1-(4-hydrazinylphenyl)-N-(2-morpholin-4-ylethoxy)methanimine;hydrochloride is Cl.NNc1ccc(C=NOCCN2CCOCC2)cc1.
What is the InChIKey of 1-(4-hydrazinylphenyl)-N-(2-morpholin-4-ylethoxy)methanimine;hydrochloride?
The InChIKey is RQBFUJOBTUNMGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2.ClH/c14-16-13-3-1-12(2-4-13)11-15-19-10-7-17-5-8-18-9-6-17;/h1-4,11,16H,5-10,14H2;1H.
What are the key properties of 1-(4-hydrazinylphenyl)-N-(2-morpholin-4-ylethoxy)methanimine;hydrochloride?
1-(4-hydrazinylphenyl)-N-(2-morpholin-4-ylethoxy)methanimine;hydrochloride has a molecular weight of 300.79 g/mol, XLogP of 1.08, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-hydrazinylphenyl)-N-(2-morpholin-4-ylethoxy)methanimine;hydrochloride is sourced from PubChem (CID 87290774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).