6-bromo-N-[(2-bromophenyl)methyl]-N-methylpyridin-2-amine

C13H12Br2N2 — CID 63962798

IUPAC6-bromo-N-[(2-bromophenyl)methyl]-N-methylpyridin-2-amine
SMILESCN(Cc1ccccc1Br)c1cccc(Br)n1
InChIInChI=1S/C13H12Br2N2/c1-17(13-8-4-7-12(15)16-13)9-10-5-2-3-6-11(10)14/h2-8H,9H2,1H3
InChIKeyDHVKTRRNNNSZPS-UHFFFAOYSA-N
MW356.06 g/mol
LogP4.24
Rot. Bonds3

About 6-bromo-N-[(2-bromophenyl)methyl]-N-methylpyridin-2-amine

6-bromo-N-[(2-bromophenyl)methyl]-N-methylpyridin-2-amine (PubChem CID 63962798) has the molecular formula C13H12Br2N2 and a molecular weight of 356.06 g/mol. Its IUPAC name is 6-bromo-N-[(2-bromophenyl)methyl]-N-methylpyridin-2-amine.

Molecular Properties

Compound Name6-bromo-N-[(2-bromophenyl)methyl]-N-methylpyridin-2-amine
PubChem CID63962798
Molecular FormulaC13H12Br2N2
Molecular Weight356.06 g/mol
Exact Mass353.94
IUPAC Name6-bromo-N-[(2-bromophenyl)methyl]-N-methylpyridin-2-amine
SMILESCN(Cc1ccccc1Br)c1cccc(Br)n1
InChIInChI=1S/C13H12Br2N2/c1-17(13-8-4-7-12(15)16-13)9-10-5-2-3-6-11(10)14/h2-8H,9H2,1H3
InChIKeyDHVKTRRNNNSZPS-UHFFFAOYSA-N
XLogP4.24
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.06
LogP ≤ 54.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 6-bromo-N-[(2-bromophenyl)methyl]-N-methylpyridin-2-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

N-[(2-bromophenyl)methyl]-N-methyl-6-(methylaminomethyl)pyridin-2-amine
CID 62292840
N-[(2-bromophenyl)methyl]-N-methyl-6-(propylaminomethyl)pyridin-2-amine
CID 62292841
4-N-[(2-bromophenyl)methyl]-2-N,4-N-dimethylpyrimidine-2,4-diamine
CID 80794402
[6-[(2-bromophenyl)methyl-methylamino]-3-chloro-2-pyridinyl]methanol
CID 61416679
3-amino-6-[(2-bromophenyl)methyl-methylamino]pyridine-2-carbonitrile
CID 103467785
N-[(2-bromophenyl)methyl]-5-(ethylaminomethyl)-N-methylpyrazin-2-amine
CID 107379580
N-[(2-bromophenyl)methyl]-2-hydrazinyl-N,6-dimethylpyrimidin-4-amine
CID 80896379
N-[(2-bromophenyl)methyl]-N-methylhydroxylamine
CID 82613877
3-[(6-bromo-2-pyridinyl)-methylamino]propan-1-ol
CID 145104975
6-bromo-N-[(3-methoxyphenyl)methyl]-N-methylpyridin-2-amine
CID 63962800
4-N-[(2-bromophenyl)methyl]-4-N-methyl-6-N-propylpyrimidine-2,4,6-triamine
CID 80778356
N-[(2-bromophenyl)methyl]-6-chloro-N-methyl-4-(trifluoromethyl)pyridin-2-amine
CID 102715585

Frequently Asked Questions

What is the IUPAC name of 6-bromo-N-[(2-bromophenyl)methyl]-N-methylpyridin-2-amine?
The IUPAC name of 6-bromo-N-[(2-bromophenyl)methyl]-N-methylpyridin-2-amine (CID 63962798) is 6-bromo-N-[(2-bromophenyl)methyl]-N-methylpyridin-2-amine.
What is the SMILES notation for 6-bromo-N-[(2-bromophenyl)methyl]-N-methylpyridin-2-amine?
The canonical SMILES for 6-bromo-N-[(2-bromophenyl)methyl]-N-methylpyridin-2-amine is CN(Cc1ccccc1Br)c1cccc(Br)n1.
What is the InChIKey of 6-bromo-N-[(2-bromophenyl)methyl]-N-methylpyridin-2-amine?
The InChIKey is DHVKTRRNNNSZPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12Br2N2/c1-17(13-8-4-7-12(15)16-13)9-10-5-2-3-6-11(10)14/h2-8H,9H2,1H3.
What are the key properties of 6-bromo-N-[(2-bromophenyl)methyl]-N-methylpyridin-2-amine?
6-bromo-N-[(2-bromophenyl)methyl]-N-methylpyridin-2-amine has a molecular weight of 356.06 g/mol, XLogP of 4.24, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-N-[(2-bromophenyl)methyl]-N-methylpyridin-2-amine is sourced from PubChem (CID 63962798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).