5-bromo-6-methyl-N-[(4-methylphenyl)methyl]pyridin-2-amine

C14H15BrN2 — CID 58338424

IUPAC5-bromo-6-methyl-N-[(4-methylphenyl)methyl]pyridin-2-amine
SMILESCc1ccc(CNc2ccc(Br)c(C)n2)cc1
InChIInChI=1S/C14H15BrN2/c1-10-3-5-12(6-4-10)9-16-14-8-7-13(15)11(2)17-14/h3-8H,9H2,1-2H3,(H,16,17)
InChIKeyFGQKOSYOSFDRMF-UHFFFAOYSA-N
MW291.19 g/mol
LogP4.07
Rot. Bonds3

About 5-bromo-6-methyl-N-[(4-methylphenyl)methyl]pyridin-2-amine

5-bromo-6-methyl-N-[(4-methylphenyl)methyl]pyridin-2-amine (PubChem CID 58338424) has the molecular formula C14H15BrN2 and a molecular weight of 291.19 g/mol. Its IUPAC name is 5-bromo-6-methyl-N-[(4-methylphenyl)methyl]pyridin-2-amine.

Molecular Properties

Compound Name5-bromo-6-methyl-N-[(4-methylphenyl)methyl]pyridin-2-amine
PubChem CID58338424
Molecular FormulaC14H15BrN2
Molecular Weight291.19 g/mol
Exact Mass290.04
IUPAC Name5-bromo-6-methyl-N-[(4-methylphenyl)methyl]pyridin-2-amine
SMILESCc1ccc(CNc2ccc(Br)c(C)n2)cc1
InChIInChI=1S/C14H15BrN2/c1-10-3-5-12(6-4-10)9-16-14-8-7-13(15)11(2)17-14/h3-8H,9H2,1-2H3,(H,16,17)
InChIKeyFGQKOSYOSFDRMF-UHFFFAOYSA-N
XLogP4.07
TPSA24.92 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 ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-bromo-6-methyl-N-[(4-methylphenyl)methyl]pyridin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-bromo-6-methyl-N-[(4-methylphenyl)methyl]pyridin-2-amine?
The IUPAC name of 5-bromo-6-methyl-N-[(4-methylphenyl)methyl]pyridin-2-amine (CID 58338424) is 5-bromo-6-methyl-N-[(4-methylphenyl)methyl]pyridin-2-amine.
What is the SMILES notation for 5-bromo-6-methyl-N-[(4-methylphenyl)methyl]pyridin-2-amine?
The canonical SMILES for 5-bromo-6-methyl-N-[(4-methylphenyl)methyl]pyridin-2-amine is Cc1ccc(CNc2ccc(Br)c(C)n2)cc1.
What is the InChIKey of 5-bromo-6-methyl-N-[(4-methylphenyl)methyl]pyridin-2-amine?
The InChIKey is FGQKOSYOSFDRMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15BrN2/c1-10-3-5-12(6-4-10)9-16-14-8-7-13(15)11(2)17-14/h3-8H,9H2,1-2H3,(H,16,17).
What are the key properties of 5-bromo-6-methyl-N-[(4-methylphenyl)methyl]pyridin-2-amine?
5-bromo-6-methyl-N-[(4-methylphenyl)methyl]pyridin-2-amine has a molecular weight of 291.19 g/mol, XLogP of 4.07, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-6-methyl-N-[(4-methylphenyl)methyl]pyridin-2-amine is sourced from PubChem (CID 58338424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).