N-[(2-bromophenyl)methyl]-N-methylazetidin-3-amine

C11H15BrN2 — CID 62784251

IUPACN-[(2-bromophenyl)methyl]-N-methylazetidin-3-amine
SMILESCN(Cc1ccccc1Br)C1CNC1
InChIInChI=1S/C11H15BrN2/c1-14(10-6-13-7-10)8-9-4-2-3-5-11(9)12/h2-5,10,13H,6-8H2,1H3
InChIKeyONBZSJUMQKUHHP-UHFFFAOYSA-N
MW255.16 g/mol
LogP1.85
Rot. Bonds3

About N-[(2-bromophenyl)methyl]-N-methylazetidin-3-amine

N-[(2-bromophenyl)methyl]-N-methylazetidin-3-amine (PubChem CID 62784251) has the molecular formula C11H15BrN2 and a molecular weight of 255.16 g/mol. Its IUPAC name is N-[(2-bromophenyl)methyl]-N-methylazetidin-3-amine.

Molecular Properties

Compound NameN-[(2-bromophenyl)methyl]-N-methylazetidin-3-amine
PubChem CID62784251
Molecular FormulaC11H15BrN2
Molecular Weight255.16 g/mol
Exact Mass254.04
IUPAC NameN-[(2-bromophenyl)methyl]-N-methylazetidin-3-amine
SMILESCN(Cc1ccccc1Br)C1CNC1
InChIInChI=1S/C11H15BrN2/c1-14(10-6-13-7-10)8-9-4-2-3-5-11(9)12/h2-5,10,13H,6-8H2,1H3
InChIKeyONBZSJUMQKUHHP-UHFFFAOYSA-N
XLogP1.85
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.16
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[(2-bromophenyl)methyl]-N-methylazetidin-3-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-methylpiperidin-4-amine;hydrochloride
CID 119912776
N-[(2-bromophenyl)methyl]-N,5,5-trimethylpyrrolidin-3-amine
CID 115146007
N-[(2-bromo-5-methoxyphenyl)methyl]-N-methylazetidin-3-amine;hydrochloride
CID 120851632
N-[(2-bromophenyl)methyl]-N-methyl-2,3,4,5-tetrahydro-1H-1-benzazepin-3-amine
CID 103314084
N-[(4-bromophenyl)methyl]-N-methylazetidin-3-amine
CID 62784806
N-[(2-bromophenyl)methyl]-N-methylhydroxylamine
CID 82613877
N-[(2-bromophenyl)methyl]-2-methyl-N-[(3S)-pyrrolidin-3-yl]propanamide
CID 11595006
N-[(2-bromophenyl)methyl]-1-cyclopropyl-N-methylmethanamine
CID 60965915
N-[(2-bromophenyl)methyl]-1,1,1-trideuterio-N-(trideuteriomethyl)methanamine
CID 155291918
1-[(2-bromophenyl)methyl]-1-methylhydrazine;hydrochloride
CID 3028721
2-(2-bromophenyl)-N-methyl-N-piperidin-4-ylacetamide
CID 83749686
N-[(2-bromophenyl)methyl]-N-propylpiperidin-4-amine
CID 54923407

Frequently Asked Questions

What is the IUPAC name of N-[(2-bromophenyl)methyl]-N-methylazetidin-3-amine?
The IUPAC name of N-[(2-bromophenyl)methyl]-N-methylazetidin-3-amine (CID 62784251) is N-[(2-bromophenyl)methyl]-N-methylazetidin-3-amine.
What is the SMILES notation for N-[(2-bromophenyl)methyl]-N-methylazetidin-3-amine?
The canonical SMILES for N-[(2-bromophenyl)methyl]-N-methylazetidin-3-amine is CN(Cc1ccccc1Br)C1CNC1.
What is the InChIKey of N-[(2-bromophenyl)methyl]-N-methylazetidin-3-amine?
The InChIKey is ONBZSJUMQKUHHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15BrN2/c1-14(10-6-13-7-10)8-9-4-2-3-5-11(9)12/h2-5,10,13H,6-8H2,1H3.
What are the key properties of N-[(2-bromophenyl)methyl]-N-methylazetidin-3-amine?
N-[(2-bromophenyl)methyl]-N-methylazetidin-3-amine has a molecular weight of 255.16 g/mol, XLogP of 1.85, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-bromophenyl)methyl]-N-methylazetidin-3-amine is sourced from PubChem (CID 62784251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).