[1-(1-benzofuran-3-yl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine

C17H17FN2O — CID 105262527

IUPAC[1-(1-benzofuran-3-yl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine
SMILESCc1cc(F)ccc1CC(NN)c1coc2ccccc12
InChIInChI=1S/C17H17FN2O/c1-11-8-13(18)7-6-12(11)9-16(20-19)15-10-21-17-5-3-2-4-14(15)17/h2-8,10,16,20H,9,19H2,1H3
InChIKeyIBXXDDDTXHVQTH-UHFFFAOYSA-N
MW284.33 g/mol
LogP3.63
Rot. Bonds4

About [1-(1-benzofuran-3-yl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine

[1-(1-benzofuran-3-yl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine (PubChem CID 105262527) has the molecular formula C17H17FN2O and a molecular weight of 284.33 g/mol. Its IUPAC name is [1-(1-benzofuran-3-yl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(1-benzofuran-3-yl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine
PubChem CID105262527
Molecular FormulaC17H17FN2O
Molecular Weight284.33 g/mol
Exact Mass284.13
IUPAC Name[1-(1-benzofuran-3-yl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine
SMILESCc1cc(F)ccc1CC(NN)c1coc2ccccc12
InChIInChI=1S/C17H17FN2O/c1-11-8-13(18)7-6-12(11)9-16(20-19)15-10-21-17-5-3-2-4-14(15)17/h2-8,10,16,20H,9,19H2,1H3
InChIKeyIBXXDDDTXHVQTH-UHFFFAOYSA-N
XLogP3.63
TPSA51.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.33
LogP ≤ 53.63
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

[2-(4-fluoro-2-methylphenyl)-1-(2,3,4-trifluorophenyl)ethyl]hydrazine
CID 105340770
[1-(2-bromo-3-fluorophenyl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine
CID 105340815
[2-(4-fluoro-2-methylphenyl)-1-pyrazolo[1,5-a]pyridin-3-ylethyl]hydrazine
CID 103129981
[2-(4-fluoro-2-methylphenyl)-1-(3-methylphenyl)ethyl]hydrazine
CID 105200828
[1-(2,5-dibromothiophen-3-yl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine
CID 114022387
1,2-bis(5-fluoro-2-methylphenyl)ethylhydrazine
CID 105377773
[1-(1-benzofuran-3-yl)-3-methylbut-3-enyl]hydrazine
CID 105262533
[1-benzofuran-3-yl-(5-fluoro-2-methoxyphenyl)methyl]hydrazine
CID 105262495
[2-(2,4-difluorophenyl)-1-(2-fluorophenyl)ethyl]hydrazine
CID 105216921
[1-(4-fluoro-2-methylphenyl)-3-methyl-3-phenylbutan-2-yl]hydrazine
CID 105216447
[2-(2,4-dichlorophenyl)-1-(4-fluoro-2-methylphenyl)ethyl]hydrazine
CID 105200119
[1-(1-benzofuran-3-yl)-2-cyclobutylethyl]hydrazine
CID 105262478

Frequently Asked Questions

What is the IUPAC name of [1-(1-benzofuran-3-yl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine?
The IUPAC name of [1-(1-benzofuran-3-yl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine (CID 105262527) is [1-(1-benzofuran-3-yl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine.
What is the SMILES notation for [1-(1-benzofuran-3-yl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine?
The canonical SMILES for [1-(1-benzofuran-3-yl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine is Cc1cc(F)ccc1CC(NN)c1coc2ccccc12.
What is the InChIKey of [1-(1-benzofuran-3-yl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine?
The InChIKey is IBXXDDDTXHVQTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17FN2O/c1-11-8-13(18)7-6-12(11)9-16(20-19)15-10-21-17-5-3-2-4-14(15)17/h2-8,10,16,20H,9,19H2,1H3.
What are the key properties of [1-(1-benzofuran-3-yl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine?
[1-(1-benzofuran-3-yl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine has a molecular weight of 284.33 g/mol, XLogP of 3.63, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1-benzofuran-3-yl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine is sourced from PubChem (CID 105262527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).