2-(3-bromo-4-methylphenyl)pyridin-3-amine

C12H11BrN2 — CID 82379977

IUPAC2-(3-bromo-4-methylphenyl)pyridin-3-amine
SMILESCc1ccc(-c2ncccc2N)cc1Br
InChIInChI=1S/C12H11BrN2/c1-8-4-5-9(7-10(8)13)12-11(14)3-2-6-15-12/h2-7H,14H2,1H3
InChIKeyCRELRXUJLZAYEU-UHFFFAOYSA-N
MW263.14 g/mol
LogP3.40
Rot. Bonds1

About 2-(3-bromo-4-methylphenyl)pyridin-3-amine

2-(3-bromo-4-methylphenyl)pyridin-3-amine (PubChem CID 82379977) has the molecular formula C12H11BrN2 and a molecular weight of 263.14 g/mol. Its IUPAC name is 2-(3-bromo-4-methylphenyl)pyridin-3-amine.

Molecular Properties

Compound Name2-(3-bromo-4-methylphenyl)pyridin-3-amine
PubChem CID82379977
Molecular FormulaC12H11BrN2
Molecular Weight263.14 g/mol
Exact Mass262.01
IUPAC Name2-(3-bromo-4-methylphenyl)pyridin-3-amine
SMILESCc1ccc(-c2ncccc2N)cc1Br
InChIInChI=1S/C12H11BrN2/c1-8-4-5-9(7-10(8)13)12-11(14)3-2-6-15-12/h2-7H,14H2,1H3
InChIKeyCRELRXUJLZAYEU-UHFFFAOYSA-N
XLogP3.40
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.14
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(3-bromo-4-methylphenyl)pyridin-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

2-(3,4-dimethoxyphenyl)pyridin-3-amine
CID 23075532
3-(3-bromo-4-methylphenyl)-1-methyl-4-pyridin-2-ylpyrazol-5-amine
CID 81460629
2-[3-(4-bromo-3,5-dimethylphenyl)-1,2,4-oxadiazol-5-yl]pyridin-3-amine
CID 114329336
3-(3-bromo-4-methylphenyl)-4-(2-bromophenyl)-1,2-oxazol-5-amine
CID 81460037
[2-(3,4-dimethylphenyl)-3-pyridinyl]methanamine
CID 82508499
2-(3-bromo-4-methylphenyl)-1,3-thiazol-4-amine
CID 107916044
4-(3-bromo-4-methylphenyl)-1,2-oxazol-5-amine
CID 117385048
2-[3-(3-bromo-4-methylphenyl)-1,2,4-oxadiazol-5-yl]-3-methylaniline
CID 107916362
2-(2-fluoro-4,6-dimethylphenyl)pyridin-3-amine
CID 106882203
2-(3,5-dibromophenyl)-3-methylpyridine
CID 155769988
(2-amino-3-pyridinyl)-(3-bromo-4-methylphenyl)methanol
CID 105402842
3-chloro-2-(3,4-dichlorophenyl)pyridine
CID 133088428

Frequently Asked Questions

What is the IUPAC name of 2-(3-bromo-4-methylphenyl)pyridin-3-amine?
The IUPAC name of 2-(3-bromo-4-methylphenyl)pyridin-3-amine (CID 82379977) is 2-(3-bromo-4-methylphenyl)pyridin-3-amine.
What is the SMILES notation for 2-(3-bromo-4-methylphenyl)pyridin-3-amine?
The canonical SMILES for 2-(3-bromo-4-methylphenyl)pyridin-3-amine is Cc1ccc(-c2ncccc2N)cc1Br.
What is the InChIKey of 2-(3-bromo-4-methylphenyl)pyridin-3-amine?
The InChIKey is CRELRXUJLZAYEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11BrN2/c1-8-4-5-9(7-10(8)13)12-11(14)3-2-6-15-12/h2-7H,14H2,1H3.
What are the key properties of 2-(3-bromo-4-methylphenyl)pyridin-3-amine?
2-(3-bromo-4-methylphenyl)pyridin-3-amine has a molecular weight of 263.14 g/mol, XLogP of 3.40, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-bromo-4-methylphenyl)pyridin-3-amine is sourced from PubChem (CID 82379977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).