1-[4-[2-(2-methylpiperazin-1-yl)propoxy]phenyl]-2-phenylhydrazine

C20H28N4O — CID 155756274

IUPAC1-[4-[2-(2-methylpiperazin-1-yl)propoxy]phenyl]-2-phenylhydrazine
SMILESCC1CNCCN1C(C)COc1ccc(NNc2ccccc2)cc1
InChIInChI=1S/C20H28N4O/c1-16-14-21-12-13-24(16)17(2)15-25-20-10-8-19(9-11-20)23-22-18-6-4-3-5-7-18/h3-11,16-17,21-23H,12-15H2,1-2H3
InChIKeyOOXOTHJAXQNHNB-UHFFFAOYSA-N
MW340.47 g/mol
LogP3.19
Rot. Bonds7

About 1-[4-[2-(2-methylpiperazin-1-yl)propoxy]phenyl]-2-phenylhydrazine

1-[4-[2-(2-methylpiperazin-1-yl)propoxy]phenyl]-2-phenylhydrazine (PubChem CID 155756274) has the molecular formula C20H28N4O and a molecular weight of 340.47 g/mol. Its IUPAC name is 1-[4-[2-(2-methylpiperazin-1-yl)propoxy]phenyl]-2-phenylhydrazine.

Molecular Properties

Compound Name1-[4-[2-(2-methylpiperazin-1-yl)propoxy]phenyl]-2-phenylhydrazine
PubChem CID155756274
Molecular FormulaC20H28N4O
Molecular Weight340.47 g/mol
Exact Mass340.23
IUPAC Name1-[4-[2-(2-methylpiperazin-1-yl)propoxy]phenyl]-2-phenylhydrazine
SMILESCC1CNCCN1C(C)COc1ccc(NNc2ccccc2)cc1
InChIInChI=1S/C20H28N4O/c1-16-14-21-12-13-24(16)17(2)15-25-20-10-8-19(9-11-20)23-22-18-6-4-3-5-7-18/h3-11,16-17,21-23H,12-15H2,1-2H3
InChIKeyOOXOTHJAXQNHNB-UHFFFAOYSA-N
XLogP3.19
TPSA48.56 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.47
LogP ≤ 53.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-[4-[2-(2-methylpiperazin-1-yl)propoxy]phenyl]-2-phenylhydrazine?
The IUPAC name of 1-[4-[2-(2-methylpiperazin-1-yl)propoxy]phenyl]-2-phenylhydrazine (CID 155756274) is 1-[4-[2-(2-methylpiperazin-1-yl)propoxy]phenyl]-2-phenylhydrazine.
What is the SMILES notation for 1-[4-[2-(2-methylpiperazin-1-yl)propoxy]phenyl]-2-phenylhydrazine?
The canonical SMILES for 1-[4-[2-(2-methylpiperazin-1-yl)propoxy]phenyl]-2-phenylhydrazine is CC1CNCCN1C(C)COc1ccc(NNc2ccccc2)cc1.
What is the InChIKey of 1-[4-[2-(2-methylpiperazin-1-yl)propoxy]phenyl]-2-phenylhydrazine?
The InChIKey is OOXOTHJAXQNHNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N4O/c1-16-14-21-12-13-24(16)17(2)15-25-20-10-8-19(9-11-20)23-22-18-6-4-3-5-7-18/h3-11,16-17,21-23H,12-15H2,1-2H3.
What are the key properties of 1-[4-[2-(2-methylpiperazin-1-yl)propoxy]phenyl]-2-phenylhydrazine?
1-[4-[2-(2-methylpiperazin-1-yl)propoxy]phenyl]-2-phenylhydrazine has a molecular weight of 340.47 g/mol, XLogP of 3.19, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[2-(2-methylpiperazin-1-yl)propoxy]phenyl]-2-phenylhydrazine is sourced from PubChem (CID 155756274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).