3-(2,6-difluoro-3-methylphenyl)-3-hydrazinyl-N,N-dimethylpropan-1-amine

C12H19F2N3 — CID 105259156

IUPAC3-(2,6-difluoro-3-methylphenyl)-3-hydrazinyl-N,N-dimethylpropan-1-amine
SMILESCc1ccc(F)c(C(CCN(C)C)NN)c1F
InChIInChI=1S/C12H19F2N3/c1-8-4-5-9(13)11(12(8)14)10(16-15)6-7-17(2)3/h4-5,10,16H,6-7,15H2,1-3H3
InChIKeyPZEQDXWOSZZKHT-UHFFFAOYSA-N
MW243.30 g/mol
LogP1.73
Rot. Bonds5

About 3-(2,6-difluoro-3-methylphenyl)-3-hydrazinyl-N,N-dimethylpropan-1-amine

3-(2,6-difluoro-3-methylphenyl)-3-hydrazinyl-N,N-dimethylpropan-1-amine (PubChem CID 105259156) has the molecular formula C12H19F2N3 and a molecular weight of 243.30 g/mol. Its IUPAC name is 3-(2,6-difluoro-3-methylphenyl)-3-hydrazinyl-N,N-dimethylpropan-1-amine.

Molecular Properties

Compound Name3-(2,6-difluoro-3-methylphenyl)-3-hydrazinyl-N,N-dimethylpropan-1-amine
PubChem CID105259156
Molecular FormulaC12H19F2N3
Molecular Weight243.30 g/mol
Exact Mass243.15
IUPAC Name3-(2,6-difluoro-3-methylphenyl)-3-hydrazinyl-N,N-dimethylpropan-1-amine
SMILESCc1ccc(F)c(C(CCN(C)C)NN)c1F
InChIInChI=1S/C12H19F2N3/c1-8-4-5-9(13)11(12(8)14)10(16-15)6-7-17(2)3/h4-5,10,16H,6-7,15H2,1-3H3
InChIKeyPZEQDXWOSZZKHT-UHFFFAOYSA-N
XLogP1.73
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.30
LogP ≤ 51.73
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'}

Analyze 3-(2,6-difluoro-3-methylphenyl)-3-hydrazinyl-N,N-dimethylpropan-1-amine 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

3-(3-bromo-2,6-difluorophenyl)-3-hydrazinyl-N,N-dimethylpropan-1-amine
CID 106945415
1-(2,6-difluoro-3-methylphenyl)hexylhydrazine
CID 105294572
3-hydrazinyl-N,N-dimethyl-3-(2,3,4-trifluorophenyl)propan-1-amine
CID 105259088
3-(4-chloro-2-fluorophenyl)-3-hydrazinyl-N,N-dimethylpropan-1-amine
CID 105259286
[2-cyclobutyl-1-(2,6-difluoro-3-methylphenyl)ethyl]hydrazine
CID 105310002
[1-(2,6-difluoro-3-methylphenyl)-2-pyridin-4-ylethyl]hydrazine
CID 105212355
[1-(2,6-difluoro-3-methylphenyl)-3-ethylheptyl]hydrazine
CID 105288270
[1-(2,6-difluoro-3-methylphenyl)-2-(2,4-difluorophenyl)ethyl]hydrazine
CID 105223092
1-(2,3-difluoro-4-methylphenyl)-N,N',N'-trimethylpropane-1,3-diamine
CID 107513729
[2-(2-chlorophenyl)-1-(2,6-difluoro-3-methylphenyl)ethyl]hydrazine
CID 105209475
1-(3-bromo-2,6-difluorophenyl)-N',N'-dimethyl-N-propylpropane-1,3-diamine
CID 106942928
[2-(5-chlorothiophen-2-yl)-1-(2,6-difluoro-3-methylphenyl)ethyl]hydrazine
CID 105295892

Frequently Asked Questions

What is the IUPAC name of 3-(2,6-difluoro-3-methylphenyl)-3-hydrazinyl-N,N-dimethylpropan-1-amine?
The IUPAC name of 3-(2,6-difluoro-3-methylphenyl)-3-hydrazinyl-N,N-dimethylpropan-1-amine (CID 105259156) is 3-(2,6-difluoro-3-methylphenyl)-3-hydrazinyl-N,N-dimethylpropan-1-amine.
What is the SMILES notation for 3-(2,6-difluoro-3-methylphenyl)-3-hydrazinyl-N,N-dimethylpropan-1-amine?
The canonical SMILES for 3-(2,6-difluoro-3-methylphenyl)-3-hydrazinyl-N,N-dimethylpropan-1-amine is Cc1ccc(F)c(C(CCN(C)C)NN)c1F.
What is the InChIKey of 3-(2,6-difluoro-3-methylphenyl)-3-hydrazinyl-N,N-dimethylpropan-1-amine?
The InChIKey is PZEQDXWOSZZKHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19F2N3/c1-8-4-5-9(13)11(12(8)14)10(16-15)6-7-17(2)3/h4-5,10,16H,6-7,15H2,1-3H3.
What are the key properties of 3-(2,6-difluoro-3-methylphenyl)-3-hydrazinyl-N,N-dimethylpropan-1-amine?
3-(2,6-difluoro-3-methylphenyl)-3-hydrazinyl-N,N-dimethylpropan-1-amine has a molecular weight of 243.30 g/mol, XLogP of 1.73, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,6-difluoro-3-methylphenyl)-3-hydrazinyl-N,N-dimethylpropan-1-amine is sourced from PubChem (CID 105259156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).