[1-(3,4-dihydro-1H-isochromen-1-yl)-2-(2-fluorophenyl)ethyl]hydrazine

C17H19FN2O — CID 105284785

IUPAC[1-(3,4-dihydro-1H-isochromen-1-yl)-2-(2-fluorophenyl)ethyl]hydrazine
SMILESNNC(Cc1ccccc1F)C1OCCc2ccccc21
InChIInChI=1S/C17H19FN2O/c18-15-8-4-2-6-13(15)11-16(20-19)17-14-7-3-1-5-12(14)9-10-21-17/h1-8,16-17,20H,9-11,19H2
InChIKeyTZIISKYAVPBGEO-UHFFFAOYSA-N
MW286.35 g/mol
LogP2.51
Rot. Bonds4

About [1-(3,4-dihydro-1H-isochromen-1-yl)-2-(2-fluorophenyl)ethyl]hydrazine

[1-(3,4-dihydro-1H-isochromen-1-yl)-2-(2-fluorophenyl)ethyl]hydrazine (PubChem CID 105284785) has the molecular formula C17H19FN2O and a molecular weight of 286.35 g/mol. Its IUPAC name is [1-(3,4-dihydro-1H-isochromen-1-yl)-2-(2-fluorophenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(3,4-dihydro-1H-isochromen-1-yl)-2-(2-fluorophenyl)ethyl]hydrazine
PubChem CID105284785
Molecular FormulaC17H19FN2O
Molecular Weight286.35 g/mol
Exact Mass286.15
IUPAC Name[1-(3,4-dihydro-1H-isochromen-1-yl)-2-(2-fluorophenyl)ethyl]hydrazine
SMILESNNC(Cc1ccccc1F)C1OCCc2ccccc21
InChIInChI=1S/C17H19FN2O/c18-15-8-4-2-6-13(15)11-16(20-19)17-14-7-3-1-5-12(14)9-10-21-17/h1-8,16-17,20H,9-11,19H2
InChIKeyTZIISKYAVPBGEO-UHFFFAOYSA-N
XLogP2.51
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.35
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-(3,4-dihydro-1H-isochromen-1-yl)-2-(2-fluorophenyl)ethanamine
CID 105090028
[1-(2,3-dihydro-1H-inden-1-yl)-2-(2-fluorophenyl)ethyl]hydrazine
CID 105234410
[1-(3,4-dihydro-1H-isochromen-1-yl)-4-methylpentyl]hydrazine
CID 105294298
1-(3,4-dihydro-1H-isochromen-1-yl)pentylhydrazine
CID 105293861
[1-(3,4-dihydro-1H-isochromen-1-yl)-2-ethoxyethyl]hydrazine
CID 105321323
1-(3,4-dihydro-1H-isochromen-1-yl)but-3-enylhydrazine
CID 105289693
1-(3,4-dihydro-1H-isochromen-1-yl)hex-5-ynylhydrazine
CID 105333523
[(3,5-difluorophenyl)-(3,4-dihydro-1H-isochromen-1-yl)methyl]hydrazine
CID 105301905
[2-(2-bromo-3-fluorophenyl)-1-(2,3-dihydro-1H-inden-1-yl)ethyl]hydrazine
CID 105234372
[2-(2-chloro-3-fluorophenyl)-1-(2,3-dihydro-1H-inden-1-yl)ethyl]hydrazine
CID 105234339
[2-(2-fluorophenyl)-1-(2-methylcyclopropyl)ethyl]hydrazine
CID 105234872
(1R)-1-[(1R)-3,4-dihydro-1H-isochromen-1-yl]propan-1-amine
CID 919561

Frequently Asked Questions

What is the IUPAC name of [1-(3,4-dihydro-1H-isochromen-1-yl)-2-(2-fluorophenyl)ethyl]hydrazine?
The IUPAC name of [1-(3,4-dihydro-1H-isochromen-1-yl)-2-(2-fluorophenyl)ethyl]hydrazine (CID 105284785) is [1-(3,4-dihydro-1H-isochromen-1-yl)-2-(2-fluorophenyl)ethyl]hydrazine.
What is the SMILES notation for [1-(3,4-dihydro-1H-isochromen-1-yl)-2-(2-fluorophenyl)ethyl]hydrazine?
The canonical SMILES for [1-(3,4-dihydro-1H-isochromen-1-yl)-2-(2-fluorophenyl)ethyl]hydrazine is NNC(Cc1ccccc1F)C1OCCc2ccccc21.
What is the InChIKey of [1-(3,4-dihydro-1H-isochromen-1-yl)-2-(2-fluorophenyl)ethyl]hydrazine?
The InChIKey is TZIISKYAVPBGEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN2O/c18-15-8-4-2-6-13(15)11-16(20-19)17-14-7-3-1-5-12(14)9-10-21-17/h1-8,16-17,20H,9-11,19H2.
What are the key properties of [1-(3,4-dihydro-1H-isochromen-1-yl)-2-(2-fluorophenyl)ethyl]hydrazine?
[1-(3,4-dihydro-1H-isochromen-1-yl)-2-(2-fluorophenyl)ethyl]hydrazine has a molecular weight of 286.35 g/mol, XLogP of 2.51, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3,4-dihydro-1H-isochromen-1-yl)-2-(2-fluorophenyl)ethyl]hydrazine is sourced from PubChem (CID 105284785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).