[1-(3-bromo-5-fluorophenyl)-3-(1-methoxycyclobutyl)propan-2-yl]hydrazine

C14H20BrFN2O — CID 103560538

IUPAC[1-(3-bromo-5-fluorophenyl)-3-(1-methoxycyclobutyl)propan-2-yl]hydrazine
SMILESCOC1(CC(Cc2cc(F)cc(Br)c2)NN)CCC1
InChIInChI=1S/C14H20BrFN2O/c1-19-14(3-2-4-14)9-13(18-17)7-10-5-11(15)8-12(16)6-10/h5-6,8,13,18H,2-4,7,9,17H2,1H3
InChIKeyDDEPRTKZEPQBHZ-UHFFFAOYSA-N
MW331.23 g/mol
LogP2.92
Rot. Bonds6

About [1-(3-bromo-5-fluorophenyl)-3-(1-methoxycyclobutyl)propan-2-yl]hydrazine

[1-(3-bromo-5-fluorophenyl)-3-(1-methoxycyclobutyl)propan-2-yl]hydrazine (PubChem CID 103560538) has the molecular formula C14H20BrFN2O and a molecular weight of 331.23 g/mol. Its IUPAC name is [1-(3-bromo-5-fluorophenyl)-3-(1-methoxycyclobutyl)propan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(3-bromo-5-fluorophenyl)-3-(1-methoxycyclobutyl)propan-2-yl]hydrazine
PubChem CID103560538
Molecular FormulaC14H20BrFN2O
Molecular Weight331.23 g/mol
Exact Mass330.07
IUPAC Name[1-(3-bromo-5-fluorophenyl)-3-(1-methoxycyclobutyl)propan-2-yl]hydrazine
SMILESCOC1(CC(Cc2cc(F)cc(Br)c2)NN)CCC1
InChIInChI=1S/C14H20BrFN2O/c1-19-14(3-2-4-14)9-13(18-17)7-10-5-11(15)8-12(16)6-10/h5-6,8,13,18H,2-4,7,9,17H2,1H3
InChIKeyDDEPRTKZEPQBHZ-UHFFFAOYSA-N
XLogP2.92
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.23
LogP ≤ 52.92
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 [1-(3-bromo-5-fluorophenyl)-3-(1-methoxycyclobutyl)propan-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-5-fluorophenyl)-3-(4-methylphenyl)propan-2-yl]hydrazine
CID 105211313
[1-(3-bromo-5-fluorophenyl)-3-cycloheptylpropan-2-yl]hydrazine
CID 105324755
[2-(3-bromo-5-fluorophenyl)-1-[1-(2-methylpropyl)cyclopentyl]ethyl]hydrazine
CID 105324822
[1-(3-bromo-5-fluorophenyl)-3-(2,6-difluorophenyl)propan-2-yl]hydrazine
CID 105324738
[1-(3-bromo-5-fluorophenyl)-3-methylsulfonylpropan-2-yl]hydrazine
CID 105324883
N-ethyl-1-(3-fluorophenyl)-3-(1-methoxycyclobutyl)propan-2-amine
CID 103556929
[1-(3-bromo-5-fluorophenyl)-3-methoxy-3-methylpentan-2-yl]hydrazine
CID 105274397
2-(3-bromo-5-fluorophenyl)-1-(1-methoxycycloheptyl)-N-methylethanamine
CID 116770078
[1-(3-bromo-5-fluorophenyl)-3-(oxolan-2-yl)propan-2-yl]hydrazine
CID 105198583
1-(5-bromo-2-fluorophenyl)-3-(1-methoxycyclobutyl)-N-methylpropan-2-amine
CID 103559180
[1-(2,5-dimethylpyrazol-3-yl)-3-(1-methoxycyclobutyl)propan-2-yl]hydrazine
CID 103560494
[2-(3-bromo-5-fluorophenyl)-1-(4,4-dimethylcyclohexyl)ethyl]hydrazine
CID 105231693

Frequently Asked Questions

What is the IUPAC name of [1-(3-bromo-5-fluorophenyl)-3-(1-methoxycyclobutyl)propan-2-yl]hydrazine?
The IUPAC name of [1-(3-bromo-5-fluorophenyl)-3-(1-methoxycyclobutyl)propan-2-yl]hydrazine (CID 103560538) is [1-(3-bromo-5-fluorophenyl)-3-(1-methoxycyclobutyl)propan-2-yl]hydrazine.
What is the SMILES notation for [1-(3-bromo-5-fluorophenyl)-3-(1-methoxycyclobutyl)propan-2-yl]hydrazine?
The canonical SMILES for [1-(3-bromo-5-fluorophenyl)-3-(1-methoxycyclobutyl)propan-2-yl]hydrazine is COC1(CC(Cc2cc(F)cc(Br)c2)NN)CCC1.
What is the InChIKey of [1-(3-bromo-5-fluorophenyl)-3-(1-methoxycyclobutyl)propan-2-yl]hydrazine?
The InChIKey is DDEPRTKZEPQBHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20BrFN2O/c1-19-14(3-2-4-14)9-13(18-17)7-10-5-11(15)8-12(16)6-10/h5-6,8,13,18H,2-4,7,9,17H2,1H3.
What are the key properties of [1-(3-bromo-5-fluorophenyl)-3-(1-methoxycyclobutyl)propan-2-yl]hydrazine?
[1-(3-bromo-5-fluorophenyl)-3-(1-methoxycyclobutyl)propan-2-yl]hydrazine has a molecular weight of 331.23 g/mol, XLogP of 2.92, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-bromo-5-fluorophenyl)-3-(1-methoxycyclobutyl)propan-2-yl]hydrazine is sourced from PubChem (CID 103560538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).