5-bromo-4-methyl-6-pyridin-2-ylsulfanylpyridin-3-amine

C11H10BrN3S — CID 104507614

IUPAC5-bromo-4-methyl-6-pyridin-2-ylsulfanylpyridin-3-amine
SMILESCc1c(N)cnc(Sc2ccccn2)c1Br
InChIInChI=1S/C11H10BrN3S/c1-7-8(13)6-15-11(10(7)12)16-9-4-2-3-5-14-9/h2-6H,13H2,1H3
InChIKeyGMSBWXWDNKOCTG-UHFFFAOYSA-N
MW296.19 g/mol
LogP3.28
Rot. Bonds2

About 5-bromo-4-methyl-6-pyridin-2-ylsulfanylpyridin-3-amine

5-bromo-4-methyl-6-pyridin-2-ylsulfanylpyridin-3-amine (PubChem CID 104507614) has the molecular formula C11H10BrN3S and a molecular weight of 296.19 g/mol. Its IUPAC name is 5-bromo-4-methyl-6-pyridin-2-ylsulfanylpyridin-3-amine.

Molecular Properties

Compound Name5-bromo-4-methyl-6-pyridin-2-ylsulfanylpyridin-3-amine
PubChem CID104507614
Molecular FormulaC11H10BrN3S
Molecular Weight296.19 g/mol
Exact Mass294.98
IUPAC Name5-bromo-4-methyl-6-pyridin-2-ylsulfanylpyridin-3-amine
SMILESCc1c(N)cnc(Sc2ccccn2)c1Br
InChIInChI=1S/C11H10BrN3S/c1-7-8(13)6-15-11(10(7)12)16-9-4-2-3-5-14-9/h2-6H,13H2,1H3
InChIKeyGMSBWXWDNKOCTG-UHFFFAOYSA-N
XLogP3.28
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.19
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-bromo-6-(1H-indol-2-ylsulfanyl)-4-methylpyridin-3-amine
CID 104507692
5-bromo-6-(3-chlorophenyl)sulfanyl-4-methylpyridin-3-amine
CID 104507662
5-bromo-6-(3,5-dichlorophenyl)sulfanyl-4-methylpyridin-3-amine
CID 112736273
5-bromo-4-pyridin-2-ylsulfanylpyridin-3-amine
CID 103519134
3-methyl-2-pyridin-2-ylsulfanylaniline
CID 115551231
6-chloro-2-pyridin-2-ylsulfanylpyridin-3-amine
CID 115474582
5-bromo-6-butylsulfanyl-4-methylpyridin-3-amine
CID 104507641
3-chloro-4,5-dimethyl-6-pyridin-2-ylsulfanylpyridazine
CID 63272351
5-methyl-6-pyridin-2-ylsulfanylpyridine-3-carbaldehyde
CID 80640360
3-[(5-amino-3-bromo-4-methyl-2-pyridinyl)sulfanyl]propan-1-ol
CID 104507687
5-bromo-4-methyl-6-(3-methylbutylsulfanyl)pyridin-3-amine
CID 107748140
5-bromo-4,6-dimethylpyridin-3-amine
CID 7060666

Frequently Asked Questions

What is the IUPAC name of 5-bromo-4-methyl-6-pyridin-2-ylsulfanylpyridin-3-amine?
The IUPAC name of 5-bromo-4-methyl-6-pyridin-2-ylsulfanylpyridin-3-amine (CID 104507614) is 5-bromo-4-methyl-6-pyridin-2-ylsulfanylpyridin-3-amine.
What is the SMILES notation for 5-bromo-4-methyl-6-pyridin-2-ylsulfanylpyridin-3-amine?
The canonical SMILES for 5-bromo-4-methyl-6-pyridin-2-ylsulfanylpyridin-3-amine is Cc1c(N)cnc(Sc2ccccn2)c1Br.
What is the InChIKey of 5-bromo-4-methyl-6-pyridin-2-ylsulfanylpyridin-3-amine?
The InChIKey is GMSBWXWDNKOCTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10BrN3S/c1-7-8(13)6-15-11(10(7)12)16-9-4-2-3-5-14-9/h2-6H,13H2,1H3.
What are the key properties of 5-bromo-4-methyl-6-pyridin-2-ylsulfanylpyridin-3-amine?
5-bromo-4-methyl-6-pyridin-2-ylsulfanylpyridin-3-amine has a molecular weight of 296.19 g/mol, XLogP of 3.28, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-4-methyl-6-pyridin-2-ylsulfanylpyridin-3-amine is sourced from PubChem (CID 104507614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).