[1-[3-(difluoromethoxy)phenyl]-2-(2-methyltetrazol-5-yl)ethyl]hydrazine

C11H14F2N6O — CID 107066949

IUPAC[1-[3-(difluoromethoxy)phenyl]-2-(2-methyltetrazol-5-yl)ethyl]hydrazine
SMILESCn1nnc(CC(NN)c2cccc(OC(F)F)c2)n1
InChIInChI=1S/C11H14F2N6O/c1-19-17-10(16-18-19)6-9(15-14)7-3-2-4-8(5-7)20-11(12)13/h2-5,9,11,15H,6,14H2,1H3
InChIKeyAYVAYWIZMKZVPE-UHFFFAOYSA-N
MW284.27 g/mol
LogP0.56
Rot. Bonds6

About [1-[3-(difluoromethoxy)phenyl]-2-(2-methyltetrazol-5-yl)ethyl]hydrazine

[1-[3-(difluoromethoxy)phenyl]-2-(2-methyltetrazol-5-yl)ethyl]hydrazine (PubChem CID 107066949) has the molecular formula C11H14F2N6O and a molecular weight of 284.27 g/mol. Its IUPAC name is [1-[3-(difluoromethoxy)phenyl]-2-(2-methyltetrazol-5-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-[3-(difluoromethoxy)phenyl]-2-(2-methyltetrazol-5-yl)ethyl]hydrazine
PubChem CID107066949
Molecular FormulaC11H14F2N6O
Molecular Weight284.27 g/mol
Exact Mass284.12
IUPAC Name[1-[3-(difluoromethoxy)phenyl]-2-(2-methyltetrazol-5-yl)ethyl]hydrazine
SMILESCn1nnc(CC(NN)c2cccc(OC(F)F)c2)n1
InChIInChI=1S/C11H14F2N6O/c1-19-17-10(16-18-19)6-9(15-14)7-3-2-4-8(5-7)20-11(12)13/h2-5,9,11,15H,6,14H2,1H3
InChIKeyAYVAYWIZMKZVPE-UHFFFAOYSA-N
XLogP0.56
TPSA90.88 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.27
LogP ≤ 50.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

Analyze [1-[3-(difluoromethoxy)phenyl]-2-(2-methyltetrazol-5-yl)ethyl]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-(difluoromethoxy)phenyl]-2-(1-methylpyrazol-3-yl)ethyl]hydrazine
CID 105329486
1-[4-(difluoromethoxy)phenyl]-N-methyl-2-(2-methyltetrazol-5-yl)ethanamine
CID 107065279
1-(3-ethoxyphenyl)-N-methyl-2-(2-methyltetrazol-5-yl)ethanamine
CID 107048319
2-(2-methyltetrazol-5-yl)-1-(3-propan-2-yloxyphenyl)ethanol
CID 107045795
[1-[3-(difluoromethoxy)phenyl]-2-(1-ethylpyrazol-4-yl)ethyl]hydrazine
CID 105291323
[1-(5-fluoro-3-pyridinyl)-2-(2-methyltetrazol-5-yl)ethyl]hydrazine
CID 107066996
N-methyl-2-(2-methyltetrazol-5-yl)-1-[3-(trifluoromethyl)phenyl]ethanamine
CID 107048370
1-(3-bromophenyl)-N-ethyl-2-(2-methyltetrazol-5-yl)ethanamine
CID 107048532
[2-(2-methyltetrazol-5-yl)-1-(2,4,6-trimethylphenyl)ethyl]hydrazine
CID 107066800
1-(3,5-dimethoxyphenyl)-N-methyl-2-(2-methyltetrazol-5-yl)ethanamine
CID 107051458
1-[3-(difluoromethoxy)phenyl]-N-methylpropan-1-amine
CID 114979665
1-[3-[(2-methyltetrazol-5-yl)methoxy]phenyl]ethanamine
CID 107041075

Frequently Asked Questions

What is the IUPAC name of [1-[3-(difluoromethoxy)phenyl]-2-(2-methyltetrazol-5-yl)ethyl]hydrazine?
The IUPAC name of [1-[3-(difluoromethoxy)phenyl]-2-(2-methyltetrazol-5-yl)ethyl]hydrazine (CID 107066949) is [1-[3-(difluoromethoxy)phenyl]-2-(2-methyltetrazol-5-yl)ethyl]hydrazine.
What is the SMILES notation for [1-[3-(difluoromethoxy)phenyl]-2-(2-methyltetrazol-5-yl)ethyl]hydrazine?
The canonical SMILES for [1-[3-(difluoromethoxy)phenyl]-2-(2-methyltetrazol-5-yl)ethyl]hydrazine is Cn1nnc(CC(NN)c2cccc(OC(F)F)c2)n1.
What is the InChIKey of [1-[3-(difluoromethoxy)phenyl]-2-(2-methyltetrazol-5-yl)ethyl]hydrazine?
The InChIKey is AYVAYWIZMKZVPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F2N6O/c1-19-17-10(16-18-19)6-9(15-14)7-3-2-4-8(5-7)20-11(12)13/h2-5,9,11,15H,6,14H2,1H3.
What are the key properties of [1-[3-(difluoromethoxy)phenyl]-2-(2-methyltetrazol-5-yl)ethyl]hydrazine?
[1-[3-(difluoromethoxy)phenyl]-2-(2-methyltetrazol-5-yl)ethyl]hydrazine has a molecular weight of 284.27 g/mol, XLogP of 0.56, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[3-(difluoromethoxy)phenyl]-2-(2-methyltetrazol-5-yl)ethyl]hydrazine is sourced from PubChem (CID 107066949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).