2-[(3-bromo-2,6-difluorophenyl)methyl]-1,1-dimethylhydrazine

C9H11BrF2N2 — CID 106263667

IUPAC2-[(3-bromo-2,6-difluorophenyl)methyl]-1,1-dimethylhydrazine
SMILESCN(C)NCc1c(F)ccc(Br)c1F
InChIInChI=1S/C9H11BrF2N2/c1-14(2)13-5-6-8(11)4-3-7(10)9(6)12/h3-4,13H,5H2,1-2H3
InChIKeyZUBDHNGLABFKFP-UHFFFAOYSA-N
MW265.10 g/mol
LogP2.29
Rot. Bonds3

About 2-[(3-bromo-2,6-difluorophenyl)methyl]-1,1-dimethylhydrazine

2-[(3-bromo-2,6-difluorophenyl)methyl]-1,1-dimethylhydrazine (PubChem CID 106263667) has the molecular formula C9H11BrF2N2 and a molecular weight of 265.10 g/mol. Its IUPAC name is 2-[(3-bromo-2,6-difluorophenyl)methyl]-1,1-dimethylhydrazine.

Molecular Properties

Compound Name2-[(3-bromo-2,6-difluorophenyl)methyl]-1,1-dimethylhydrazine
PubChem CID106263667
Molecular FormulaC9H11BrF2N2
Molecular Weight265.10 g/mol
Exact Mass264.01
IUPAC Name2-[(3-bromo-2,6-difluorophenyl)methyl]-1,1-dimethylhydrazine
SMILESCN(C)NCc1c(F)ccc(Br)c1F
InChIInChI=1S/C9H11BrF2N2/c1-14(2)13-5-6-8(11)4-3-7(10)9(6)12/h3-4,13H,5H2,1-2H3
InChIKeyZUBDHNGLABFKFP-UHFFFAOYSA-N
XLogP2.29
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.10
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[(3-bromo-2,6-difluorophenyl)methyl]-1-(4-bromophenyl)ethanamine
CID 106263328
(1R)-N-[(3-bromo-2,6-difluorophenyl)methyl]-1-(4-bromophenyl)ethanamine
CID 106263598
N-[(3-bromo-2,6-difluorophenyl)methyl]-2-methylpropan-1-amine
CID 106942499
3-[(3-bromo-2,6-difluorophenyl)methylamino]-N,N-dimethylpropanamide
CID 106263370
1-(3-bromo-2,6-difluorophenyl)-N-[(1-methylcyclobutyl)methyl]methanamine
CID 114165735
(1R)-N-[(3-bromo-2,6-difluorophenyl)methyl]-1-phenylethanamine
CID 106263465
N-[(3-bromo-2,6-difluorophenyl)methyl]-2-chloropropan-1-amine
CID 106272287
N-[(3-bromo-2,6-difluorophenyl)methyl]-1-(4-methylphenyl)ethanamine
CID 106263340
1-(3-bromo-2,6-difluorophenyl)-N-[(1-methylcyclopentyl)methyl]methanamine
CID 114165676
N-[(3-bromo-2,6-difluorophenyl)methyl]pentan-1-amine
CID 106263073
N-[(3-bromo-2,6-difluorophenyl)methyl]-3-methylbut-2-en-1-amine
CID 106263936
N-[(3-bromo-2,6-difluorophenyl)methyl]-1-(2-methylcyclopropyl)methanamine
CID 106263727

Frequently Asked Questions

What is the IUPAC name of 2-[(3-bromo-2,6-difluorophenyl)methyl]-1,1-dimethylhydrazine?
The IUPAC name of 2-[(3-bromo-2,6-difluorophenyl)methyl]-1,1-dimethylhydrazine (CID 106263667) is 2-[(3-bromo-2,6-difluorophenyl)methyl]-1,1-dimethylhydrazine.
What is the SMILES notation for 2-[(3-bromo-2,6-difluorophenyl)methyl]-1,1-dimethylhydrazine?
The canonical SMILES for 2-[(3-bromo-2,6-difluorophenyl)methyl]-1,1-dimethylhydrazine is CN(C)NCc1c(F)ccc(Br)c1F.
What is the InChIKey of 2-[(3-bromo-2,6-difluorophenyl)methyl]-1,1-dimethylhydrazine?
The InChIKey is ZUBDHNGLABFKFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11BrF2N2/c1-14(2)13-5-6-8(11)4-3-7(10)9(6)12/h3-4,13H,5H2,1-2H3.
What are the key properties of 2-[(3-bromo-2,6-difluorophenyl)methyl]-1,1-dimethylhydrazine?
2-[(3-bromo-2,6-difluorophenyl)methyl]-1,1-dimethylhydrazine has a molecular weight of 265.10 g/mol, XLogP of 2.29, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-bromo-2,6-difluorophenyl)methyl]-1,1-dimethylhydrazine is sourced from PubChem (CID 106263667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).