[1-(3,4-difluorophenyl)-3-(4-iodophenyl)propan-2-yl]hydrazine

C15H15F2IN2 — CID 105310411

IUPAC[1-(3,4-difluorophenyl)-3-(4-iodophenyl)propan-2-yl]hydrazine
SMILESNNC(Cc1ccc(I)cc1)Cc1ccc(F)c(F)c1
InChIInChI=1S/C15H15F2IN2/c16-14-6-3-11(9-15(14)17)8-13(20-19)7-10-1-4-12(18)5-2-10/h1-6,9,13,20H,7-8,19H2
InChIKeyYBMQTBAVBFRNIC-UHFFFAOYSA-N
MW388.20 g/mol
LogP3.19
Rot. Bonds5

About [1-(3,4-difluorophenyl)-3-(4-iodophenyl)propan-2-yl]hydrazine

[1-(3,4-difluorophenyl)-3-(4-iodophenyl)propan-2-yl]hydrazine (PubChem CID 105310411) has the molecular formula C15H15F2IN2 and a molecular weight of 388.20 g/mol. Its IUPAC name is [1-(3,4-difluorophenyl)-3-(4-iodophenyl)propan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(3,4-difluorophenyl)-3-(4-iodophenyl)propan-2-yl]hydrazine
PubChem CID105310411
Molecular FormulaC15H15F2IN2
Molecular Weight388.20 g/mol
Exact Mass388.02
IUPAC Name[1-(3,4-difluorophenyl)-3-(4-iodophenyl)propan-2-yl]hydrazine
SMILESNNC(Cc1ccc(I)cc1)Cc1ccc(F)c(F)c1
InChIInChI=1S/C15H15F2IN2/c16-14-6-3-11(9-15(14)17)8-13(20-19)7-10-1-4-12(18)5-2-10/h1-6,9,13,20H,7-8,19H2
InChIKeyYBMQTBAVBFRNIC-UHFFFAOYSA-N
XLogP3.19
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.20
LogP ≤ 53.19
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

[1-(3,4-difluorophenyl)-4-methoxybutan-2-yl]hydrazine
CID 105206458
[1-(4-chlorophenoxy)-3-(3,4-difluorophenyl)propan-2-yl]hydrazine
CID 105330358
[1-(3,4-difluorophenyl)-5-methoxyhexan-2-yl]hydrazine
CID 105330394
[1-(3,4-difluorophenyl)-4-methylsulfanylbutan-2-yl]hydrazine
CID 105330380
1-(3,4-difluorophenyl)heptan-2-ylhydrazine
CID 105294767
[1-cyclobutyl-3-(3,4-difluorophenyl)propan-2-yl]hydrazine
CID 105310203
[1-(3,4-difluorophenyl)-3-(5-ethylthiophen-2-yl)propan-2-yl]hydrazine
CID 105296513
[4,4,4-trifluoro-1-(4-iodophenyl)butan-2-yl]hydrazine
CID 105205984
[1-(3-bromo-4-fluorophenyl)-3-(4-chlorophenyl)propan-2-yl]hydrazine
CID 105197541
1-(3,4-difluorophenyl)octan-2-ylhydrazine
CID 105294121
[1-(3,4-difluorophenyl)-3-(1-propan-2-ylpyrazol-3-yl)propan-2-yl]hydrazine
CID 105312820
[1-(3-chloro-2-fluorophenyl)-3-(4-iodophenyl)propan-2-yl]hydrazine
CID 105264373

Frequently Asked Questions

What is the IUPAC name of [1-(3,4-difluorophenyl)-3-(4-iodophenyl)propan-2-yl]hydrazine?
The IUPAC name of [1-(3,4-difluorophenyl)-3-(4-iodophenyl)propan-2-yl]hydrazine (CID 105310411) is [1-(3,4-difluorophenyl)-3-(4-iodophenyl)propan-2-yl]hydrazine.
What is the SMILES notation for [1-(3,4-difluorophenyl)-3-(4-iodophenyl)propan-2-yl]hydrazine?
The canonical SMILES for [1-(3,4-difluorophenyl)-3-(4-iodophenyl)propan-2-yl]hydrazine is NNC(Cc1ccc(I)cc1)Cc1ccc(F)c(F)c1.
What is the InChIKey of [1-(3,4-difluorophenyl)-3-(4-iodophenyl)propan-2-yl]hydrazine?
The InChIKey is YBMQTBAVBFRNIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15F2IN2/c16-14-6-3-11(9-15(14)17)8-13(20-19)7-10-1-4-12(18)5-2-10/h1-6,9,13,20H,7-8,19H2.
What are the key properties of [1-(3,4-difluorophenyl)-3-(4-iodophenyl)propan-2-yl]hydrazine?
[1-(3,4-difluorophenyl)-3-(4-iodophenyl)propan-2-yl]hydrazine has a molecular weight of 388.20 g/mol, XLogP of 3.19, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3,4-difluorophenyl)-3-(4-iodophenyl)propan-2-yl]hydrazine is sourced from PubChem (CID 105310411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).