[2-(2-chloro-3-fluorophenyl)-1-(2,3-dihydro-1H-inden-1-yl)ethyl]hydrazine

C17H18ClFN2 — CID 105234339

IUPAC[2-(2-chloro-3-fluorophenyl)-1-(2,3-dihydro-1H-inden-1-yl)ethyl]hydrazine
SMILESNNC(Cc1cccc(F)c1Cl)C1CCc2ccccc21
InChIInChI=1S/C17H18ClFN2/c18-17-12(5-3-7-15(17)19)10-16(21-20)14-9-8-11-4-1-2-6-13(11)14/h1-7,14,16,21H,8-10,20H2
InChIKeySUJGVENARIYKQJ-UHFFFAOYSA-N
MW304.80 g/mol
LogP3.58
Rot. Bonds4

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

[2-(2-chloro-3-fluorophenyl)-1-(2,3-dihydro-1H-inden-1-yl)ethyl]hydrazine (PubChem CID 105234339) has the molecular formula C17H18ClFN2 and a molecular weight of 304.80 g/mol. Its IUPAC name is [2-(2-chloro-3-fluorophenyl)-1-(2,3-dihydro-1H-inden-1-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(2-chloro-3-fluorophenyl)-1-(2,3-dihydro-1H-inden-1-yl)ethyl]hydrazine
PubChem CID105234339
Molecular FormulaC17H18ClFN2
Molecular Weight304.80 g/mol
Exact Mass304.11
IUPAC Name[2-(2-chloro-3-fluorophenyl)-1-(2,3-dihydro-1H-inden-1-yl)ethyl]hydrazine
SMILESNNC(Cc1cccc(F)c1Cl)C1CCc2ccccc21
InChIInChI=1S/C17H18ClFN2/c18-17-12(5-3-7-15(17)19)10-16(21-20)14-9-8-11-4-1-2-6-13(11)14/h1-7,14,16,21H,8-10,20H2
InChIKeySUJGVENARIYKQJ-UHFFFAOYSA-N
XLogP3.58
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.80
LogP ≤ 53.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', '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 [2-(2-chloro-3-fluorophenyl)-1-(2,3-dihydro-1H-inden-1-yl)ethyl]hydrazine?
The IUPAC name of [2-(2-chloro-3-fluorophenyl)-1-(2,3-dihydro-1H-inden-1-yl)ethyl]hydrazine (CID 105234339) is [2-(2-chloro-3-fluorophenyl)-1-(2,3-dihydro-1H-inden-1-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(2-chloro-3-fluorophenyl)-1-(2,3-dihydro-1H-inden-1-yl)ethyl]hydrazine?
The canonical SMILES for [2-(2-chloro-3-fluorophenyl)-1-(2,3-dihydro-1H-inden-1-yl)ethyl]hydrazine is NNC(Cc1cccc(F)c1Cl)C1CCc2ccccc21.
What is the InChIKey of [2-(2-chloro-3-fluorophenyl)-1-(2,3-dihydro-1H-inden-1-yl)ethyl]hydrazine?
The InChIKey is SUJGVENARIYKQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18ClFN2/c18-17-12(5-3-7-15(17)19)10-16(21-20)14-9-8-11-4-1-2-6-13(11)14/h1-7,14,16,21H,8-10,20H2.
What are the key properties of [2-(2-chloro-3-fluorophenyl)-1-(2,3-dihydro-1H-inden-1-yl)ethyl]hydrazine?
[2-(2-chloro-3-fluorophenyl)-1-(2,3-dihydro-1H-inden-1-yl)ethyl]hydrazine has a molecular weight of 304.80 g/mol, XLogP of 3.58, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-chloro-3-fluorophenyl)-1-(2,3-dihydro-1H-inden-1-yl)ethyl]hydrazine is sourced from PubChem (CID 105234339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).