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

C16H17IN2 — CID 114195243

IUPAC[2,3-dihydro-1H-inden-5-yl-(4-iodophenyl)methyl]hydrazine
SMILESNNC(c1ccc(I)cc1)c1ccc2c(c1)CCC2
InChIInChI=1S/C16H17IN2/c17-15-8-6-12(7-9-15)16(19-18)14-5-4-11-2-1-3-13(11)10-14/h4-10,16,19H,1-3,18H2
InChIKeyWHYKUKDITSVGMT-UHFFFAOYSA-N
MW364.23 g/mol
LogP3.33
Rot. Bonds3

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

[2,3-dihydro-1H-inden-5-yl-(4-iodophenyl)methyl]hydrazine (PubChem CID 114195243) has the molecular formula C16H17IN2 and a molecular weight of 364.23 g/mol. Its IUPAC name is [2,3-dihydro-1H-inden-5-yl-(4-iodophenyl)methyl]hydrazine.

Molecular Properties

Compound Name[2,3-dihydro-1H-inden-5-yl-(4-iodophenyl)methyl]hydrazine
PubChem CID114195243
Molecular FormulaC16H17IN2
Molecular Weight364.23 g/mol
Exact Mass364.04
IUPAC Name[2,3-dihydro-1H-inden-5-yl-(4-iodophenyl)methyl]hydrazine
SMILESNNC(c1ccc(I)cc1)c1ccc2c(c1)CCC2
InChIInChI=1S/C16H17IN2/c17-15-8-6-12(7-9-15)16(19-18)14-5-4-11-2-1-3-13(11)10-14/h4-10,16,19H,1-3,18H2
InChIKeyWHYKUKDITSVGMT-UHFFFAOYSA-N
XLogP3.33
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.23
LogP ≤ 53.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

[2,3-dihydro-1H-inden-5-yl(furan-3-yl)methyl]hydrazine
CID 105305866
[2,3-dihydro-1H-inden-5-yl-(2,6-dimethylphenyl)methyl]hydrazine
CID 114195251
[(2-chloro-5-fluorophenyl)-(2,3-dihydro-1H-inden-5-yl)methyl]hydrazine
CID 105398023
[(2,5-difluorophenyl)-(2,3-dihydro-1H-inden-5-yl)methyl]hydrazine
CID 105303372
[(2,5-dichlorothiophen-3-yl)-(2,3-dihydro-1H-inden-5-yl)methyl]hydrazine
CID 114195260
[(4-chloro-1-methylpyrazol-5-yl)-(2,3-dihydro-1H-inden-5-yl)methyl]hydrazine
CID 105338870
[(4-iodophenyl)-naphthalen-2-ylmethyl]hydrazine
CID 105301574
[(2-bromo-5-chlorophenyl)-(2,3-dihydro-1H-inden-5-yl)methyl]hydrazine
CID 114195282
[2,3-dihydro-1H-inden-5-yl-(1-propylpyrazol-4-yl)methyl]hydrazine
CID 105288546
[2,3-dihydro-1H-inden-5-yl-(1-methylimidazol-2-yl)methyl]hydrazine
CID 105308266
[(3-bromo-2-methylphenyl)-(2,3-dihydro-1H-inden-5-yl)methyl]hydrazine
CID 114195253
[2,3-dihydro-1H-inden-5-yl-(2-fluoro-4,6-dimethylphenyl)methyl]hydrazine
CID 106884532

Frequently Asked Questions

What is the IUPAC name of [2,3-dihydro-1H-inden-5-yl-(4-iodophenyl)methyl]hydrazine?
The IUPAC name of [2,3-dihydro-1H-inden-5-yl-(4-iodophenyl)methyl]hydrazine (CID 114195243) is [2,3-dihydro-1H-inden-5-yl-(4-iodophenyl)methyl]hydrazine.
What is the SMILES notation for [2,3-dihydro-1H-inden-5-yl-(4-iodophenyl)methyl]hydrazine?
The canonical SMILES for [2,3-dihydro-1H-inden-5-yl-(4-iodophenyl)methyl]hydrazine is NNC(c1ccc(I)cc1)c1ccc2c(c1)CCC2.
What is the InChIKey of [2,3-dihydro-1H-inden-5-yl-(4-iodophenyl)methyl]hydrazine?
The InChIKey is WHYKUKDITSVGMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17IN2/c17-15-8-6-12(7-9-15)16(19-18)14-5-4-11-2-1-3-13(11)10-14/h4-10,16,19H,1-3,18H2.
What are the key properties of [2,3-dihydro-1H-inden-5-yl-(4-iodophenyl)methyl]hydrazine?
[2,3-dihydro-1H-inden-5-yl-(4-iodophenyl)methyl]hydrazine has a molecular weight of 364.23 g/mol, XLogP of 3.33, 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-(4-iodophenyl)methyl]hydrazine is sourced from PubChem (CID 114195243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).