(3-bromophenyl)-(3-methoxyphenyl)methanamine

C14H14BrNO — CID 59671726

IUPAC(3-bromophenyl)-(3-methoxyphenyl)methanamine
SMILESCOc1cccc(C(N)c2cccc(Br)c2)c1
InChIInChI=1S/C14H14BrNO/c1-17-13-7-3-5-11(9-13)14(16)10-4-2-6-12(15)8-10/h2-9,14H,16H2,1H3
InChIKeyHDXISPMRLANIEE-UHFFFAOYSA-N
MW292.18 g/mol
LogP3.51
Rot. Bonds3

About (3-bromophenyl)-(3-methoxyphenyl)methanamine

(3-bromophenyl)-(3-methoxyphenyl)methanamine (PubChem CID 59671726) has the molecular formula C14H14BrNO and a molecular weight of 292.18 g/mol. Its IUPAC name is (3-bromophenyl)-(3-methoxyphenyl)methanamine.

Molecular Properties

Compound Name(3-bromophenyl)-(3-methoxyphenyl)methanamine
PubChem CID59671726
Molecular FormulaC14H14BrNO
Molecular Weight292.18 g/mol
Exact Mass291.03
IUPAC Name(3-bromophenyl)-(3-methoxyphenyl)methanamine
SMILESCOc1cccc(C(N)c2cccc(Br)c2)c1
InChIInChI=1S/C14H14BrNO/c1-17-13-7-3-5-11(9-13)14(16)10-4-2-6-12(15)8-10/h2-9,14H,16H2,1H3
InChIKeyHDXISPMRLANIEE-UHFFFAOYSA-N
XLogP3.51
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.18
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (3-bromophenyl)-(3-methoxyphenyl)methanamine 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

(1S)-N-[(1R)-1-(3-bromophenyl)ethyl]-1-(3-methoxyphenyl)ethanamine
CID 93318714
(1S)-N-[(1S)-1-(3-bromophenyl)ethyl]-1-(3-methoxyphenyl)ethanamine
CID 93318712
4-[amino-(3-methoxyphenyl)methyl]aniline
CID 116936827
(2-bromo-5-methoxyphenyl)-(3-methoxyphenyl)methanamine
CID 105086328
(4-iodophenyl)-(3-methoxyphenyl)methanamine
CID 115785175
(3-bromophenyl)-(3-fluoro-4-methoxyphenyl)methanamine
CID 43474225
(2-bromo-3-fluorophenyl)-(3-methoxyphenyl)methanamine
CID 115785913
(6-bromo-3-methyl-1-benzofuran-2-yl)-(3-methoxyphenyl)methanamine
CID 102949451
(3-fluoro-4-methylphenyl)-(3-methoxyphenyl)methanamine
CID 60819510
(2-chlorophenyl)-(3-methoxyphenyl)methanamine;hydrochloride
CID 54595163
[2-bromo-5-(trifluoromethyl)phenyl]-(3-methoxyphenyl)methanamine
CID 45282000
1-(3-methoxyphenyl)ethanamine;hydrochloride
CID 19864848

Frequently Asked Questions

What is the IUPAC name of (3-bromophenyl)-(3-methoxyphenyl)methanamine?
The IUPAC name of (3-bromophenyl)-(3-methoxyphenyl)methanamine (CID 59671726) is (3-bromophenyl)-(3-methoxyphenyl)methanamine.
What is the SMILES notation for (3-bromophenyl)-(3-methoxyphenyl)methanamine?
The canonical SMILES for (3-bromophenyl)-(3-methoxyphenyl)methanamine is COc1cccc(C(N)c2cccc(Br)c2)c1.
What is the InChIKey of (3-bromophenyl)-(3-methoxyphenyl)methanamine?
The InChIKey is HDXISPMRLANIEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14BrNO/c1-17-13-7-3-5-11(9-13)14(16)10-4-2-6-12(15)8-10/h2-9,14H,16H2,1H3.
What are the key properties of (3-bromophenyl)-(3-methoxyphenyl)methanamine?
(3-bromophenyl)-(3-methoxyphenyl)methanamine has a molecular weight of 292.18 g/mol, XLogP of 3.51, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-bromophenyl)-(3-methoxyphenyl)methanamine is sourced from PubChem (CID 59671726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).