2-(2-bromophenyl)-1-(2-methyl-3-pyridinyl)ethanamine

C14H15BrN2 — CID 105087456

IUPAC2-(2-bromophenyl)-1-(2-methyl-3-pyridinyl)ethanamine
SMILESCc1ncccc1C(N)Cc1ccccc1Br
InChIInChI=1S/C14H15BrN2/c1-10-12(6-4-8-17-10)14(16)9-11-5-2-3-7-13(11)15/h2-8,14H,9,16H2,1H3
InChIKeyQMGDGLWRLNLYOO-UHFFFAOYSA-N
MW291.19 g/mol
LogP3.40
Rot. Bonds3

About 2-(2-bromophenyl)-1-(2-methyl-3-pyridinyl)ethanamine

2-(2-bromophenyl)-1-(2-methyl-3-pyridinyl)ethanamine (PubChem CID 105087456) has the molecular formula C14H15BrN2 and a molecular weight of 291.19 g/mol. Its IUPAC name is 2-(2-bromophenyl)-1-(2-methyl-3-pyridinyl)ethanamine.

Molecular Properties

Compound Name2-(2-bromophenyl)-1-(2-methyl-3-pyridinyl)ethanamine
PubChem CID105087456
Molecular FormulaC14H15BrN2
Molecular Weight291.19 g/mol
Exact Mass290.04
IUPAC Name2-(2-bromophenyl)-1-(2-methyl-3-pyridinyl)ethanamine
SMILESCc1ncccc1C(N)Cc1ccccc1Br
InChIInChI=1S/C14H15BrN2/c1-10-12(6-4-8-17-10)14(16)9-11-5-2-3-7-13(11)15/h2-8,14H,9,16H2,1H3
InChIKeyQMGDGLWRLNLYOO-UHFFFAOYSA-N
XLogP3.40
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.19
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(2-bromophenyl)-1-(2-methyl-3-pyridinyl)ethanamine 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

(2S)-2-amino-2-(2-methyl-3-pyridinyl)ethanol
CID 55263472
2-(2-bromophenyl)-1-(2-methylquinolin-4-yl)ethanamine
CID 105087602
2-(3-bromo-4-methoxyphenyl)-1-(2-methyl-3-pyridinyl)ethanamine
CID 105110877
3-ethyl-1-(2-methyl-3-pyridinyl)pentan-1-amine
CID 105176719
1-(3-bromo-2-methylphenyl)-2-quinolin-4-ylethanamine
CID 104997403
1-(2-methyl-3-pyridinyl)-2-(2-methyl-1,2,4-triazol-3-yl)ethanamine
CID 105159432
(1S)-1-(2-methyl-3-pyridinyl)ethanamine
CID 94864826
2-(2-bromophenyl)-1-(2-methylpyrazol-3-yl)ethanamine
CID 63962245
1-(2-methyl-3-pyridinyl)tridecan-1-amine
CID 105138527
1-(2-methyl-3-pyridinyl)-2-[3-(trifluoromethyl)phenyl]ethanamine
CID 105123435
2-(5-chloro-2,3-dihydro-1-benzofuran-7-yl)-1-(2-methyl-3-pyridinyl)ethanamine
CID 105178387
1-(1-benzothiophen-7-yl)-2-(2-bromophenyl)ethanamine
CID 81153697

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromophenyl)-1-(2-methyl-3-pyridinyl)ethanamine?
The IUPAC name of 2-(2-bromophenyl)-1-(2-methyl-3-pyridinyl)ethanamine (CID 105087456) is 2-(2-bromophenyl)-1-(2-methyl-3-pyridinyl)ethanamine.
What is the SMILES notation for 2-(2-bromophenyl)-1-(2-methyl-3-pyridinyl)ethanamine?
The canonical SMILES for 2-(2-bromophenyl)-1-(2-methyl-3-pyridinyl)ethanamine is Cc1ncccc1C(N)Cc1ccccc1Br.
What is the InChIKey of 2-(2-bromophenyl)-1-(2-methyl-3-pyridinyl)ethanamine?
The InChIKey is QMGDGLWRLNLYOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15BrN2/c1-10-12(6-4-8-17-10)14(16)9-11-5-2-3-7-13(11)15/h2-8,14H,9,16H2,1H3.
What are the key properties of 2-(2-bromophenyl)-1-(2-methyl-3-pyridinyl)ethanamine?
2-(2-bromophenyl)-1-(2-methyl-3-pyridinyl)ethanamine has a molecular weight of 291.19 g/mol, XLogP of 3.40, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromophenyl)-1-(2-methyl-3-pyridinyl)ethanamine is sourced from PubChem (CID 105087456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).