6-(2-bromophenyl)-N-(3-methylsulfanylphenyl)pyridin-2-amine

C18H15BrN2S — CID 69038540

IUPAC6-(2-bromophenyl)-N-(3-methylsulfanylphenyl)pyridin-2-amine
SMILESCSc1cccc(Nc2cccc(-c3ccccc3Br)n2)c1
InChIInChI=1S/C18H15BrN2S/c1-22-14-7-4-6-13(12-14)20-18-11-5-10-17(21-18)15-8-2-3-9-16(15)19/h2-12H,1H3,(H,20,21)
InChIKeyBXRODWHGHQDTPN-UHFFFAOYSA-N
MW371.30 g/mol
LogP5.98
Rot. Bonds4

About 6-(2-bromophenyl)-N-(3-methylsulfanylphenyl)pyridin-2-amine

6-(2-bromophenyl)-N-(3-methylsulfanylphenyl)pyridin-2-amine (PubChem CID 69038540) has the molecular formula C18H15BrN2S and a molecular weight of 371.30 g/mol. Its IUPAC name is 6-(2-bromophenyl)-N-(3-methylsulfanylphenyl)pyridin-2-amine.

Molecular Properties

Compound Name6-(2-bromophenyl)-N-(3-methylsulfanylphenyl)pyridin-2-amine
PubChem CID69038540
Molecular FormulaC18H15BrN2S
Molecular Weight371.30 g/mol
Exact Mass370.01
IUPAC Name6-(2-bromophenyl)-N-(3-methylsulfanylphenyl)pyridin-2-amine
SMILESCSc1cccc(Nc2cccc(-c3ccccc3Br)n2)c1
InChIInChI=1S/C18H15BrN2S/c1-22-14-7-4-6-13(12-14)20-18-11-5-10-17(21-18)15-8-2-3-9-16(15)19/h2-12H,1H3,(H,20,21)
InChIKeyBXRODWHGHQDTPN-UHFFFAOYSA-N
XLogP5.98
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500371.30
LogP ≤ 55.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-(2-bromophenyl)-N-(3-methylsulfanylphenyl)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

Related Compounds

6-N-(3-methylsulfanylphenyl)pyridine-2,6-diamine
CID 80647295
6-chloro-2-methylsulfanyl-N-(3-methylsulfanylphenyl)pyrimidin-4-amine
CID 80544469
4-bromo-N-(3-methylsulfanylphenyl)-1,3-thiazol-2-amine
CID 79399128
2-tert-butyl-6-chloro-N-(3-methylsulfanylphenyl)pyrimidin-4-amine
CID 80948595
5-(3-methylsulfanylanilino)-2H-1,2,4-triazine-3-thione
CID 23412179
6-(2-methylphenyl)-N-[6-(2-methylphenyl)-2-pyridinyl]pyridin-2-amine
CID 71110099
6-hydrazinyl-N-(3-methylsulfanylphenyl)-2-propan-2-ylpyrimidin-4-amine
CID 80969003
2-cyclopropyl-6-hydrazinyl-N-(3-methylsulfanylphenyl)pyrimidin-4-amine
CID 80969098
5-methyl-N-(3-methylsulfanylphenyl)-1H-imidazol-2-amine
CID 106555444
6-bromo-N-(3-methylsulfanylphenyl)-1,3-benzothiazol-2-amine
CID 79534156
6-methyl-2-N-(3-methylsulfanylphenyl)pyridine-2,3-diamine
CID 79020854
4-(2-bromophenyl)-2-methylsulfanyl-1H-pyrimidin-6-one
CID 137025467

Frequently Asked Questions

What is the IUPAC name of 6-(2-bromophenyl)-N-(3-methylsulfanylphenyl)pyridin-2-amine?
The IUPAC name of 6-(2-bromophenyl)-N-(3-methylsulfanylphenyl)pyridin-2-amine (CID 69038540) is 6-(2-bromophenyl)-N-(3-methylsulfanylphenyl)pyridin-2-amine.
What is the SMILES notation for 6-(2-bromophenyl)-N-(3-methylsulfanylphenyl)pyridin-2-amine?
The canonical SMILES for 6-(2-bromophenyl)-N-(3-methylsulfanylphenyl)pyridin-2-amine is CSc1cccc(Nc2cccc(-c3ccccc3Br)n2)c1.
What is the InChIKey of 6-(2-bromophenyl)-N-(3-methylsulfanylphenyl)pyridin-2-amine?
The InChIKey is BXRODWHGHQDTPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15BrN2S/c1-22-14-7-4-6-13(12-14)20-18-11-5-10-17(21-18)15-8-2-3-9-16(15)19/h2-12H,1H3,(H,20,21).
What are the key properties of 6-(2-bromophenyl)-N-(3-methylsulfanylphenyl)pyridin-2-amine?
6-(2-bromophenyl)-N-(3-methylsulfanylphenyl)pyridin-2-amine has a molecular weight of 371.30 g/mol, XLogP of 5.98, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-bromophenyl)-N-(3-methylsulfanylphenyl)pyridin-2-amine is sourced from PubChem (CID 69038540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).