[1-(2-bromo-3,4-difluorophenyl)-2,2-dimethylpropyl]hydrazine

C11H15BrF2N2 — CID 107541408

IUPAC[1-(2-bromo-3,4-difluorophenyl)-2,2-dimethylpropyl]hydrazine
SMILESCC(C)(C)C(NN)c1ccc(F)c(F)c1Br
InChIInChI=1S/C11H15BrF2N2/c1-11(2,3)10(16-15)6-4-5-7(13)9(14)8(6)12/h4-5,10,16H,15H2,1-3H3
InChIKeyYHHARBPDFJAWBK-UHFFFAOYSA-N
MW293.16 g/mol
LogP3.28
Rot. Bonds2

About [1-(2-bromo-3,4-difluorophenyl)-2,2-dimethylpropyl]hydrazine

[1-(2-bromo-3,4-difluorophenyl)-2,2-dimethylpropyl]hydrazine (PubChem CID 107541408) has the molecular formula C11H15BrF2N2 and a molecular weight of 293.16 g/mol. Its IUPAC name is [1-(2-bromo-3,4-difluorophenyl)-2,2-dimethylpropyl]hydrazine.

Molecular Properties

Compound Name[1-(2-bromo-3,4-difluorophenyl)-2,2-dimethylpropyl]hydrazine
PubChem CID107541408
Molecular FormulaC11H15BrF2N2
Molecular Weight293.16 g/mol
Exact Mass292.04
IUPAC Name[1-(2-bromo-3,4-difluorophenyl)-2,2-dimethylpropyl]hydrazine
SMILESCC(C)(C)C(NN)c1ccc(F)c(F)c1Br
InChIInChI=1S/C11H15BrF2N2/c1-11(2,3)10(16-15)6-4-5-7(13)9(14)8(6)12/h4-5,10,16H,15H2,1-3H3
InChIKeyYHHARBPDFJAWBK-UHFFFAOYSA-N
XLogP3.28
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.16
LogP ≤ 53.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-(2-bromo-3,4-difluorophenyl)-2,2-dimethylpropan-1-amine
CID 103852505
[(2-bromo-3,4-difluorophenyl)-(2,4,5-trimethylphenyl)methyl]hydrazine
CID 107541299
[1-(2-bromo-3,4-difluorophenyl)-2-methylprop-2-enyl]hydrazine
CID 107541321
(1S)-1-(2-bromo-3,4-difluorophenyl)ethanamine
CID 103739050
1-(2-bromo-3,4-difluorophenyl)ethanamine
CID 84699199
[(2-bromo-3,4-difluorophenyl)-(4-bromothiophen-3-yl)methyl]hydrazine
CID 107541246
[(4-bromo-3-chloro-2-fluorophenyl)-(2-bromo-3,4-difluorophenyl)methyl]hydrazine
CID 107541279
[2-methoxy-2-methyl-1-(2,3,4-trifluorophenyl)propyl]hydrazine
CID 105245230
(2-bromo-3,4-difluorophenyl)-(4-tert-butylphenyl)methanamine
CID 107538899
[(2-bromo-3,4-difluorophenyl)-(3-fluoro-5-methylphenyl)methyl]hydrazine
CID 107541248
[(2-bromo-3,4-difluorophenyl)-(3,5-dimethylcyclohexyl)methyl]hydrazine
CID 107541415
[(2-bromo-3,4-difluorophenyl)-(3-methylthiophen-2-yl)methyl]hydrazine
CID 107541161

Frequently Asked Questions

What is the IUPAC name of [1-(2-bromo-3,4-difluorophenyl)-2,2-dimethylpropyl]hydrazine?
The IUPAC name of [1-(2-bromo-3,4-difluorophenyl)-2,2-dimethylpropyl]hydrazine (CID 107541408) is [1-(2-bromo-3,4-difluorophenyl)-2,2-dimethylpropyl]hydrazine.
What is the SMILES notation for [1-(2-bromo-3,4-difluorophenyl)-2,2-dimethylpropyl]hydrazine?
The canonical SMILES for [1-(2-bromo-3,4-difluorophenyl)-2,2-dimethylpropyl]hydrazine is CC(C)(C)C(NN)c1ccc(F)c(F)c1Br.
What is the InChIKey of [1-(2-bromo-3,4-difluorophenyl)-2,2-dimethylpropyl]hydrazine?
The InChIKey is YHHARBPDFJAWBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15BrF2N2/c1-11(2,3)10(16-15)6-4-5-7(13)9(14)8(6)12/h4-5,10,16H,15H2,1-3H3.
What are the key properties of [1-(2-bromo-3,4-difluorophenyl)-2,2-dimethylpropyl]hydrazine?
[1-(2-bromo-3,4-difluorophenyl)-2,2-dimethylpropyl]hydrazine has a molecular weight of 293.16 g/mol, XLogP of 3.28, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-bromo-3,4-difluorophenyl)-2,2-dimethylpropyl]hydrazine is sourced from PubChem (CID 107541408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).