[1-(2,6-difluorophenyl)-3-propoxypropan-2-yl]hydrazine

C12H18F2N2O — CID 105210157

IUPAC[1-(2,6-difluorophenyl)-3-propoxypropan-2-yl]hydrazine
SMILESCCCOCC(Cc1c(F)cccc1F)NN
InChIInChI=1S/C12H18F2N2O/c1-2-6-17-8-9(16-15)7-10-11(13)4-3-5-12(10)14/h3-5,9,16H,2,6-8,15H2,1H3
InChIKeyKDYYPEHMNQKRON-UHFFFAOYSA-N
MW244.28 g/mol
LogP1.77
Rot. Bonds7

About [1-(2,6-difluorophenyl)-3-propoxypropan-2-yl]hydrazine

[1-(2,6-difluorophenyl)-3-propoxypropan-2-yl]hydrazine (PubChem CID 105210157) has the molecular formula C12H18F2N2O and a molecular weight of 244.28 g/mol. Its IUPAC name is [1-(2,6-difluorophenyl)-3-propoxypropan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(2,6-difluorophenyl)-3-propoxypropan-2-yl]hydrazine
PubChem CID105210157
Molecular FormulaC12H18F2N2O
Molecular Weight244.28 g/mol
Exact Mass244.14
IUPAC Name[1-(2,6-difluorophenyl)-3-propoxypropan-2-yl]hydrazine
SMILESCCCOCC(Cc1c(F)cccc1F)NN
InChIInChI=1S/C12H18F2N2O/c1-2-6-17-8-9(16-15)7-10-11(13)4-3-5-12(10)14/h3-5,9,16H,2,6-8,15H2,1H3
InChIKeyKDYYPEHMNQKRON-UHFFFAOYSA-N
XLogP1.77
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.28
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze [1-(2,6-difluorophenyl)-3-propoxypropan-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-(3-bromo-2,6-difluorophenyl)-3-propoxypropan-2-yl]hydrazine
CID 106270835
[1-(2-fluorophenyl)sulfanyl-3-propoxypropan-2-yl]hydrazine
CID 105236110
[1-(2,6-difluorophenyl)-3-propan-2-yloxypropan-2-yl]hydrazine
CID 105323657
(1-naphthalen-1-yl-3-propoxypropan-2-yl)hydrazine
CID 105210084
[1-(2,6-difluorophenyl)-4,4,4-trifluorobutan-2-yl]hydrazine
CID 105206168
[1-(2,6-difluorophenyl)-3-(4-fluorophenyl)propan-2-yl]hydrazine
CID 105198434
[1-(2,6-difluorophenyl)-3-ethylpentan-2-yl]hydrazine
CID 105323976
[1-(2-bromo-3-fluorophenyl)-3-(2,6-difluorophenyl)propan-2-yl]hydrazine
CID 105327024
[1-(2,6-difluorophenyl)-4,6-dimethylheptan-2-yl]hydrazine
CID 114201921
[1-(3,4-dimethylphenyl)-3-propoxypropan-2-yl]hydrazine
CID 105210031
[1-(2,6-dichlorophenyl)-4-propoxybutan-2-yl]hydrazine
CID 105293129
1-(2,3-difluorophenyl)-3-propoxy-N-propylpropan-2-amine
CID 55094101

Frequently Asked Questions

What is the IUPAC name of [1-(2,6-difluorophenyl)-3-propoxypropan-2-yl]hydrazine?
The IUPAC name of [1-(2,6-difluorophenyl)-3-propoxypropan-2-yl]hydrazine (CID 105210157) is [1-(2,6-difluorophenyl)-3-propoxypropan-2-yl]hydrazine.
What is the SMILES notation for [1-(2,6-difluorophenyl)-3-propoxypropan-2-yl]hydrazine?
The canonical SMILES for [1-(2,6-difluorophenyl)-3-propoxypropan-2-yl]hydrazine is CCCOCC(Cc1c(F)cccc1F)NN.
What is the InChIKey of [1-(2,6-difluorophenyl)-3-propoxypropan-2-yl]hydrazine?
The InChIKey is KDYYPEHMNQKRON-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18F2N2O/c1-2-6-17-8-9(16-15)7-10-11(13)4-3-5-12(10)14/h3-5,9,16H,2,6-8,15H2,1H3.
What are the key properties of [1-(2,6-difluorophenyl)-3-propoxypropan-2-yl]hydrazine?
[1-(2,6-difluorophenyl)-3-propoxypropan-2-yl]hydrazine has a molecular weight of 244.28 g/mol, XLogP of 1.77, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,6-difluorophenyl)-3-propoxypropan-2-yl]hydrazine is sourced from PubChem (CID 105210157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).