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

C19H25FN4 — CID 155756323

IUPAC1-[4-fluoro-2-[1-(2-methylpiperazin-1-yl)ethyl]phenyl]-2-phenylhydrazine
SMILESCC1CNCCN1C(C)c1cc(F)ccc1NNc1ccccc1
InChIInChI=1S/C19H25FN4/c1-14-13-21-10-11-24(14)15(2)18-12-16(20)8-9-19(18)23-22-17-6-4-3-5-7-17/h3-9,12,14-15,21-23H,10-11,13H2,1-2H3
InChIKeyFLPZPYQAKBCIFV-UHFFFAOYSA-N
MW328.44 g/mol
LogP3.62
Rot. Bonds5

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

1-[4-fluoro-2-[1-(2-methylpiperazin-1-yl)ethyl]phenyl]-2-phenylhydrazine (PubChem CID 155756323) has the molecular formula C19H25FN4 and a molecular weight of 328.44 g/mol. Its IUPAC name is 1-[4-fluoro-2-[1-(2-methylpiperazin-1-yl)ethyl]phenyl]-2-phenylhydrazine.

Molecular Properties

Compound Name1-[4-fluoro-2-[1-(2-methylpiperazin-1-yl)ethyl]phenyl]-2-phenylhydrazine
PubChem CID155756323
Molecular FormulaC19H25FN4
Molecular Weight328.44 g/mol
Exact Mass328.21
IUPAC Name1-[4-fluoro-2-[1-(2-methylpiperazin-1-yl)ethyl]phenyl]-2-phenylhydrazine
SMILESCC1CNCCN1C(C)c1cc(F)ccc1NNc1ccccc1
InChIInChI=1S/C19H25FN4/c1-14-13-21-10-11-24(14)15(2)18-12-16(20)8-9-19(18)23-22-17-6-4-3-5-7-17/h3-9,12,14-15,21-23H,10-11,13H2,1-2H3
InChIKeyFLPZPYQAKBCIFV-UHFFFAOYSA-N
XLogP3.62
TPSA39.33 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.44
LogP ≤ 53.62
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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-fluoro-2-[1-(2-methylpiperazin-1-yl)ethyl]phenyl]-2-phenylhydrazine?
The IUPAC name of 1-[4-fluoro-2-[1-(2-methylpiperazin-1-yl)ethyl]phenyl]-2-phenylhydrazine (CID 155756323) is 1-[4-fluoro-2-[1-(2-methylpiperazin-1-yl)ethyl]phenyl]-2-phenylhydrazine.
What is the SMILES notation for 1-[4-fluoro-2-[1-(2-methylpiperazin-1-yl)ethyl]phenyl]-2-phenylhydrazine?
The canonical SMILES for 1-[4-fluoro-2-[1-(2-methylpiperazin-1-yl)ethyl]phenyl]-2-phenylhydrazine is CC1CNCCN1C(C)c1cc(F)ccc1NNc1ccccc1.
What is the InChIKey of 1-[4-fluoro-2-[1-(2-methylpiperazin-1-yl)ethyl]phenyl]-2-phenylhydrazine?
The InChIKey is FLPZPYQAKBCIFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25FN4/c1-14-13-21-10-11-24(14)15(2)18-12-16(20)8-9-19(18)23-22-17-6-4-3-5-7-17/h3-9,12,14-15,21-23H,10-11,13H2,1-2H3.
What are the key properties of 1-[4-fluoro-2-[1-(2-methylpiperazin-1-yl)ethyl]phenyl]-2-phenylhydrazine?
1-[4-fluoro-2-[1-(2-methylpiperazin-1-yl)ethyl]phenyl]-2-phenylhydrazine has a molecular weight of 328.44 g/mol, XLogP of 3.62, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-fluoro-2-[1-(2-methylpiperazin-1-yl)ethyl]phenyl]-2-phenylhydrazine is sourced from PubChem (CID 155756323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).