1-[2-(4-bromophenoxy)phenyl]-N,N-dimethylmethanamine

C15H16BrNO — CID 23378645

IUPAC1-[2-(4-bromophenoxy)phenyl]-N,N-dimethylmethanamine
SMILESCN(C)Cc1ccccc1Oc1ccc(Br)cc1
InChIInChI=1S/C15H16BrNO/c1-17(2)11-12-5-3-4-6-15(12)18-14-9-7-13(16)8-10-14/h3-10H,11H2,1-2H3
InChIKeyOLYZEORLRJZNQC-UHFFFAOYSA-N
MW306.20 g/mol
LogP4.30
Rot. Bonds4

About 1-[2-(4-bromophenoxy)phenyl]-N,N-dimethylmethanamine

1-[2-(4-bromophenoxy)phenyl]-N,N-dimethylmethanamine (PubChem CID 23378645) has the molecular formula C15H16BrNO and a molecular weight of 306.20 g/mol. Its IUPAC name is 1-[2-(4-bromophenoxy)phenyl]-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-[2-(4-bromophenoxy)phenyl]-N,N-dimethylmethanamine
PubChem CID23378645
Molecular FormulaC15H16BrNO
Molecular Weight306.20 g/mol
Exact Mass305.04
IUPAC Name1-[2-(4-bromophenoxy)phenyl]-N,N-dimethylmethanamine
SMILESCN(C)Cc1ccccc1Oc1ccc(Br)cc1
InChIInChI=1S/C15H16BrNO/c1-17(2)11-12-5-3-4-6-15(12)18-14-9-7-13(16)8-10-14/h3-10H,11H2,1-2H3
InChIKeyOLYZEORLRJZNQC-UHFFFAOYSA-N
XLogP4.30
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.20
LogP ≤ 54.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-[2-(4-bromophenoxy)phenyl]-N,N-dimethylmethanamine 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

5-HT/NA Reuptake inhibitor-1
CID 826600
(5-bromo-2-(4-(methylthio)phenoxy)phenyl)-N-methylmethanamine
CID 18428716
4-(5-Bromo-2-methoxybenzyl)thiomorpholine
CID 763011
1-(5-Bromo-2-methoxybenzyl)azepane
CID 764311
N-benzyl-N-ethyl-3-(2-methoxyphenyl)-2-propen-1-amine
CID 783682
N-benzyl-3-(2-sec-butylphenoxy)-N-methyl-1-propanamine
CID 2936074
N-benzyl-N-butyl-3-(2-methoxyphenyl)-2-propen-1-amine
CID 5721711
1-[5-bromo-2-[(4-chlorophenyl)methoxy]phenyl]-N,N-dimethyl-methanamine
CID 11210440
(5-bromo-2-(4-(methylthio)phenoxy)phenyl)-N,N-dimethylmethanamine
CID 23378652
N,N-dimethyl-1-(2-(p-tolyloxy)phenyl)methanamine
CID 44563029
N-(5-bromo-2-isobutoxybenzyl)-2-methyl-2-propanamine hydrochloride
CID 2980736
1-(5-Bromo-2-methoxy-benzyl)-azocane
CID 791262

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-bromophenoxy)phenyl]-N,N-dimethylmethanamine?
The IUPAC name of 1-[2-(4-bromophenoxy)phenyl]-N,N-dimethylmethanamine (CID 23378645) is 1-[2-(4-bromophenoxy)phenyl]-N,N-dimethylmethanamine.
What is the SMILES notation for 1-[2-(4-bromophenoxy)phenyl]-N,N-dimethylmethanamine?
The canonical SMILES for 1-[2-(4-bromophenoxy)phenyl]-N,N-dimethylmethanamine is CN(C)Cc1ccccc1Oc1ccc(Br)cc1.
What is the InChIKey of 1-[2-(4-bromophenoxy)phenyl]-N,N-dimethylmethanamine?
The InChIKey is OLYZEORLRJZNQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16BrNO/c1-17(2)11-12-5-3-4-6-15(12)18-14-9-7-13(16)8-10-14/h3-10H,11H2,1-2H3.
What are the key properties of 1-[2-(4-bromophenoxy)phenyl]-N,N-dimethylmethanamine?
1-[2-(4-bromophenoxy)phenyl]-N,N-dimethylmethanamine has a molecular weight of 306.20 g/mol, XLogP of 4.30, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-bromophenoxy)phenyl]-N,N-dimethylmethanamine is sourced from PubChem (CID 23378645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).