[1-(2,6-difluorophenyl)-4-methylpent-3-en-2-yl]hydrazine

C12H16F2N2 — CID 105319719

IUPAC[1-(2,6-difluorophenyl)-4-methylpent-3-en-2-yl]hydrazine
SMILESCC(C)=CC(Cc1c(F)cccc1F)NN
InChIInChI=1S/C12H16F2N2/c1-8(2)6-9(16-15)7-10-11(13)4-3-5-12(10)14/h3-6,9,16H,7,15H2,1-2H3
InChIKeyFKMUPMKQAYLYQZ-UHFFFAOYSA-N
MW226.27 g/mol
LogP2.31
Rot. Bonds4

About [1-(2,6-difluorophenyl)-4-methylpent-3-en-2-yl]hydrazine

[1-(2,6-difluorophenyl)-4-methylpent-3-en-2-yl]hydrazine (PubChem CID 105319719) has the molecular formula C12H16F2N2 and a molecular weight of 226.27 g/mol. Its IUPAC name is [1-(2,6-difluorophenyl)-4-methylpent-3-en-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(2,6-difluorophenyl)-4-methylpent-3-en-2-yl]hydrazine
PubChem CID105319719
Molecular FormulaC12H16F2N2
Molecular Weight226.27 g/mol
Exact Mass226.13
IUPAC Name[1-(2,6-difluorophenyl)-4-methylpent-3-en-2-yl]hydrazine
SMILESCC(C)=CC(Cc1c(F)cccc1F)NN
InChIInChI=1S/C12H16F2N2/c1-8(2)6-9(16-15)7-10-11(13)4-3-5-12(10)14/h3-6,9,16H,7,15H2,1-2H3
InChIKeyFKMUPMKQAYLYQZ-UHFFFAOYSA-N
XLogP2.31
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.27
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze [1-(2,6-difluorophenyl)-4-methylpent-3-en-2-yl]hydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[1-(2,6-difluorophenyl)-3,4-dimethylpentan-2-yl]hydrazine
CID 105342903
[1-(2,6-difluorophenyl)-3-ethylpentan-2-yl]hydrazine
CID 105323976
1-(2-chloro-6-fluorophenyl)-4-methylpent-3-en-2-ol
CID 115817012
[1-tert-butylsulfanyl-3-(2,6-difluorophenyl)propan-2-yl]hydrazine
CID 105226612
[1-(2,6-difluorophenyl)-5-methoxy-3-methylpentan-2-yl]hydrazine
CID 105337870
[1-cyclopropyl-3-(2,6-difluorophenyl)propan-2-yl]hydrazine
CID 105254222
2-(3-chloro-2-methylpropyl)-1,3-difluorobenzene
CID 18989689
[1-(2,6-difluorophenyl)-4,6-dimethylheptan-2-yl]hydrazine
CID 114201921
[2-(2,6-difluorophenyl)-1-thiophen-3-ylethyl]hydrazine
CID 105196943
[1-(2,6-difluorophenyl)-3-propan-2-yloxypropan-2-yl]hydrazine
CID 105323657
[1-(2,6-difluorophenyl)-4,4,4-trifluorobutan-2-yl]hydrazine
CID 105206168
1-(2,6-difluorophenyl)butane-2,3-diol
CID 103452859

Frequently Asked Questions

What is the IUPAC name of [1-(2,6-difluorophenyl)-4-methylpent-3-en-2-yl]hydrazine?
The IUPAC name of [1-(2,6-difluorophenyl)-4-methylpent-3-en-2-yl]hydrazine (CID 105319719) is [1-(2,6-difluorophenyl)-4-methylpent-3-en-2-yl]hydrazine.
What is the SMILES notation for [1-(2,6-difluorophenyl)-4-methylpent-3-en-2-yl]hydrazine?
The canonical SMILES for [1-(2,6-difluorophenyl)-4-methylpent-3-en-2-yl]hydrazine is CC(C)=CC(Cc1c(F)cccc1F)NN.
What is the InChIKey of [1-(2,6-difluorophenyl)-4-methylpent-3-en-2-yl]hydrazine?
The InChIKey is FKMUPMKQAYLYQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16F2N2/c1-8(2)6-9(16-15)7-10-11(13)4-3-5-12(10)14/h3-6,9,16H,7,15H2,1-2H3.
What are the key properties of [1-(2,6-difluorophenyl)-4-methylpent-3-en-2-yl]hydrazine?
[1-(2,6-difluorophenyl)-4-methylpent-3-en-2-yl]hydrazine has a molecular weight of 226.27 g/mol, XLogP of 2.31, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,6-difluorophenyl)-4-methylpent-3-en-2-yl]hydrazine is sourced from PubChem (CID 105319719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).