[2,3-dihydro-1H-inden-5-yl-(2-fluoro-4,6-dimethylphenyl)methyl]hydrazine

C18H21FN2 — CID 106884532

IUPAC[2,3-dihydro-1H-inden-5-yl-(2-fluoro-4,6-dimethylphenyl)methyl]hydrazine
SMILESCc1cc(C)c(C(NN)c2ccc3c(c2)CCC3)c(F)c1
InChIInChI=1S/C18H21FN2/c1-11-8-12(2)17(16(19)9-11)18(21-20)15-7-6-13-4-3-5-14(13)10-15/h6-10,18,21H,3-5,20H2,1-2H3
InChIKeyQMYZSJQLQLERPV-UHFFFAOYSA-N
MW284.38 g/mol
LogP3.48
Rot. Bonds3

About [2,3-dihydro-1H-inden-5-yl-(2-fluoro-4,6-dimethylphenyl)methyl]hydrazine

[2,3-dihydro-1H-inden-5-yl-(2-fluoro-4,6-dimethylphenyl)methyl]hydrazine (PubChem CID 106884532) has the molecular formula C18H21FN2 and a molecular weight of 284.38 g/mol. Its IUPAC name is [2,3-dihydro-1H-inden-5-yl-(2-fluoro-4,6-dimethylphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[2,3-dihydro-1H-inden-5-yl-(2-fluoro-4,6-dimethylphenyl)methyl]hydrazine
PubChem CID106884532
Molecular FormulaC18H21FN2
Molecular Weight284.38 g/mol
Exact Mass284.17
IUPAC Name[2,3-dihydro-1H-inden-5-yl-(2-fluoro-4,6-dimethylphenyl)methyl]hydrazine
SMILESCc1cc(C)c(C(NN)c2ccc3c(c2)CCC3)c(F)c1
InChIInChI=1S/C18H21FN2/c1-11-8-12(2)17(16(19)9-11)18(21-20)15-7-6-13-4-3-5-14(13)10-15/h6-10,18,21H,3-5,20H2,1-2H3
InChIKeyQMYZSJQLQLERPV-UHFFFAOYSA-N
XLogP3.48
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.38
LogP ≤ 53.48
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 [2,3-dihydro-1H-inden-5-yl-(2-fluoro-4,6-dimethylphenyl)methyl]hydrazine?
The IUPAC name of [2,3-dihydro-1H-inden-5-yl-(2-fluoro-4,6-dimethylphenyl)methyl]hydrazine (CID 106884532) is [2,3-dihydro-1H-inden-5-yl-(2-fluoro-4,6-dimethylphenyl)methyl]hydrazine.
What is the SMILES notation for [2,3-dihydro-1H-inden-5-yl-(2-fluoro-4,6-dimethylphenyl)methyl]hydrazine?
The canonical SMILES for [2,3-dihydro-1H-inden-5-yl-(2-fluoro-4,6-dimethylphenyl)methyl]hydrazine is Cc1cc(C)c(C(NN)c2ccc3c(c2)CCC3)c(F)c1.
What is the InChIKey of [2,3-dihydro-1H-inden-5-yl-(2-fluoro-4,6-dimethylphenyl)methyl]hydrazine?
The InChIKey is QMYZSJQLQLERPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21FN2/c1-11-8-12(2)17(16(19)9-11)18(21-20)15-7-6-13-4-3-5-14(13)10-15/h6-10,18,21H,3-5,20H2,1-2H3.
What are the key properties of [2,3-dihydro-1H-inden-5-yl-(2-fluoro-4,6-dimethylphenyl)methyl]hydrazine?
[2,3-dihydro-1H-inden-5-yl-(2-fluoro-4,6-dimethylphenyl)methyl]hydrazine has a molecular weight of 284.38 g/mol, XLogP of 3.48, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2,3-dihydro-1H-inden-5-yl-(2-fluoro-4,6-dimethylphenyl)methyl]hydrazine is sourced from PubChem (CID 106884532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).