1-[4-(4-methylpiperazin-1-yl)phenyl]-2-(4-morpholin-4-ylphenyl)hydrazine

C21H29N5O — CID 123306233

IUPAC1-[4-(4-methylpiperazin-1-yl)phenyl]-2-(4-morpholin-4-ylphenyl)hydrazine
SMILESCN1CCN(c2ccc(NNc3ccc(N4CCOCC4)cc3)cc2)CC1
InChIInChI=1S/C21H29N5O/c1-24-10-12-25(13-11-24)20-6-2-18(3-7-20)22-23-19-4-8-21(9-5-19)26-14-16-27-17-15-26/h2-9,22-23H,10-17H2,1H3
InChIKeyJFOKPNZUEOCNHL-UHFFFAOYSA-N
MW367.50 g/mol
LogP2.71
Rot. Bonds5

About 1-[4-(4-methylpiperazin-1-yl)phenyl]-2-(4-morpholin-4-ylphenyl)hydrazine

1-[4-(4-methylpiperazin-1-yl)phenyl]-2-(4-morpholin-4-ylphenyl)hydrazine (PubChem CID 123306233) has the molecular formula C21H29N5O and a molecular weight of 367.50 g/mol. Its IUPAC name is 1-[4-(4-methylpiperazin-1-yl)phenyl]-2-(4-morpholin-4-ylphenyl)hydrazine.

Molecular Properties

Compound Name1-[4-(4-methylpiperazin-1-yl)phenyl]-2-(4-morpholin-4-ylphenyl)hydrazine
PubChem CID123306233
Molecular FormulaC21H29N5O
Molecular Weight367.50 g/mol
Exact Mass367.24
IUPAC Name1-[4-(4-methylpiperazin-1-yl)phenyl]-2-(4-morpholin-4-ylphenyl)hydrazine
SMILESCN1CCN(c2ccc(NNc3ccc(N4CCOCC4)cc3)cc2)CC1
InChIInChI=1S/C21H29N5O/c1-24-10-12-25(13-11-24)20-6-2-18(3-7-20)22-23-19-4-8-21(9-5-19)26-14-16-27-17-15-26/h2-9,22-23H,10-17H2,1H3
InChIKeyJFOKPNZUEOCNHL-UHFFFAOYSA-N
XLogP2.71
TPSA43.01 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.50
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', '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-(4-methylpiperazin-1-yl)phenyl]-2-(4-morpholin-4-ylphenyl)hydrazine?
The IUPAC name of 1-[4-(4-methylpiperazin-1-yl)phenyl]-2-(4-morpholin-4-ylphenyl)hydrazine (CID 123306233) is 1-[4-(4-methylpiperazin-1-yl)phenyl]-2-(4-morpholin-4-ylphenyl)hydrazine.
What is the SMILES notation for 1-[4-(4-methylpiperazin-1-yl)phenyl]-2-(4-morpholin-4-ylphenyl)hydrazine?
The canonical SMILES for 1-[4-(4-methylpiperazin-1-yl)phenyl]-2-(4-morpholin-4-ylphenyl)hydrazine is CN1CCN(c2ccc(NNc3ccc(N4CCOCC4)cc3)cc2)CC1.
What is the InChIKey of 1-[4-(4-methylpiperazin-1-yl)phenyl]-2-(4-morpholin-4-ylphenyl)hydrazine?
The InChIKey is JFOKPNZUEOCNHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H29N5O/c1-24-10-12-25(13-11-24)20-6-2-18(3-7-20)22-23-19-4-8-21(9-5-19)26-14-16-27-17-15-26/h2-9,22-23H,10-17H2,1H3.
What are the key properties of 1-[4-(4-methylpiperazin-1-yl)phenyl]-2-(4-morpholin-4-ylphenyl)hydrazine?
1-[4-(4-methylpiperazin-1-yl)phenyl]-2-(4-morpholin-4-ylphenyl)hydrazine has a molecular weight of 367.50 g/mol, XLogP of 2.71, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(4-methylpiperazin-1-yl)phenyl]-2-(4-morpholin-4-ylphenyl)hydrazine is sourced from PubChem (CID 123306233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).