3-(2,3-difluorophenyl)-2-hydrazinyl-N,N-dimethylpropan-1-amine

C11H17F2N3 — CID 105244886

IUPAC3-(2,3-difluorophenyl)-2-hydrazinyl-N,N-dimethylpropan-1-amine
SMILESCN(C)CC(Cc1cccc(F)c1F)NN
InChIInChI=1S/C11H17F2N3/c1-16(2)7-9(15-14)6-8-4-3-5-10(12)11(8)13/h3-5,9,15H,6-7,14H2,1-2H3
InChIKeyCALKITNWEHLGRO-UHFFFAOYSA-N
MW229.27 g/mol
LogP0.90
Rot. Bonds5

About 3-(2,3-difluorophenyl)-2-hydrazinyl-N,N-dimethylpropan-1-amine

3-(2,3-difluorophenyl)-2-hydrazinyl-N,N-dimethylpropan-1-amine (PubChem CID 105244886) has the molecular formula C11H17F2N3 and a molecular weight of 229.27 g/mol. Its IUPAC name is 3-(2,3-difluorophenyl)-2-hydrazinyl-N,N-dimethylpropan-1-amine.

Molecular Properties

Compound Name3-(2,3-difluorophenyl)-2-hydrazinyl-N,N-dimethylpropan-1-amine
PubChem CID105244886
Molecular FormulaC11H17F2N3
Molecular Weight229.27 g/mol
Exact Mass229.14
IUPAC Name3-(2,3-difluorophenyl)-2-hydrazinyl-N,N-dimethylpropan-1-amine
SMILESCN(C)CC(Cc1cccc(F)c1F)NN
InChIInChI=1S/C11H17F2N3/c1-16(2)7-9(15-14)6-8-4-3-5-10(12)11(8)13/h3-5,9,15H,6-7,14H2,1-2H3
InChIKeyCALKITNWEHLGRO-UHFFFAOYSA-N
XLogP0.90
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.27
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-(2,3-difluorophenyl)-3-hydrazinyl-N,N-dimethylbutan-1-amine
CID 105259354
4-(2,3-difluorophenyl)-N,N-diethyl-3-hydrazinylbutan-1-amine
CID 105244189
[1-cyclohexyl-3-(2,3-difluorophenyl)propan-2-yl]hydrazine
CID 105296152
4-(2,3-difluorophenyl)-1-N,1-N,3-N-trimethylbutane-1,3-diamine
CID 113291249
[1-(2,6-dichlorophenyl)-3-(2,3-difluorophenyl)propan-2-yl]hydrazine
CID 105209834
[1-(2,3-difluorophenyl)-4-methylheptan-2-yl]hydrazine
CID 105298128
[1-(4-chloro-2-fluorophenyl)-3-(2,3-difluorophenyl)propan-2-yl]hydrazine
CID 105342687
[1-(2,3-difluorophenyl)-4,6,6-trimethylheptan-2-yl]hydrazine
CID 105297922
3-(3-fluorophenyl)-2-hydrazinyl-N,N-dimethylpropan-1-amine
CID 105244646
[1-(2,3-difluorophenyl)-4-(3-methylphenyl)butan-2-yl]hydrazine
CID 105298035
1-(2,3-difluorophenyl)hept-6-yn-2-ylhydrazine
CID 105333380
4-(2-bromo-3-fluorophenyl)-3-hydrazinyl-N,N-dimethylbutan-1-amine
CID 105259150

Frequently Asked Questions

What is the IUPAC name of 3-(2,3-difluorophenyl)-2-hydrazinyl-N,N-dimethylpropan-1-amine?
The IUPAC name of 3-(2,3-difluorophenyl)-2-hydrazinyl-N,N-dimethylpropan-1-amine (CID 105244886) is 3-(2,3-difluorophenyl)-2-hydrazinyl-N,N-dimethylpropan-1-amine.
What is the SMILES notation for 3-(2,3-difluorophenyl)-2-hydrazinyl-N,N-dimethylpropan-1-amine?
The canonical SMILES for 3-(2,3-difluorophenyl)-2-hydrazinyl-N,N-dimethylpropan-1-amine is CN(C)CC(Cc1cccc(F)c1F)NN.
What is the InChIKey of 3-(2,3-difluorophenyl)-2-hydrazinyl-N,N-dimethylpropan-1-amine?
The InChIKey is CALKITNWEHLGRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17F2N3/c1-16(2)7-9(15-14)6-8-4-3-5-10(12)11(8)13/h3-5,9,15H,6-7,14H2,1-2H3.
What are the key properties of 3-(2,3-difluorophenyl)-2-hydrazinyl-N,N-dimethylpropan-1-amine?
3-(2,3-difluorophenyl)-2-hydrazinyl-N,N-dimethylpropan-1-amine has a molecular weight of 229.27 g/mol, XLogP of 0.90, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-difluorophenyl)-2-hydrazinyl-N,N-dimethylpropan-1-amine is sourced from PubChem (CID 105244886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).