6-(2-methylphenyl)sulfanylpyridin-3-amine

C12H12N2S — CID 901270

IUPAC6-(2-methylphenyl)sulfanylpyridin-3-amine
SMILESCc1ccccc1Sc1ccc(N)cn1
InChIInChI=1S/C12H12N2S/c1-9-4-2-3-5-11(9)15-12-7-6-10(13)8-14-12/h2-8H,13H2,1H3
InChIKeyYNHBISGORKMJEC-UHFFFAOYSA-N
MW216.31 g/mol
LogP3.12
Rot. Bonds2

About 6-(2-methylphenyl)sulfanylpyridin-3-amine

6-(2-methylphenyl)sulfanylpyridin-3-amine (PubChem CID 901270) has the molecular formula C12H12N2S and a molecular weight of 216.31 g/mol. Its IUPAC name is 6-(2-methylphenyl)sulfanylpyridin-3-amine.

Molecular Properties

Compound Name6-(2-methylphenyl)sulfanylpyridin-3-amine
PubChem CID901270
Molecular FormulaC12H12N2S
Molecular Weight216.31 g/mol
Exact Mass216.07
IUPAC Name6-(2-methylphenyl)sulfanylpyridin-3-amine
SMILESCc1ccccc1Sc1ccc(N)cn1
InChIInChI=1S/C12H12N2S/c1-9-4-2-3-5-11(9)15-12-7-6-10(13)8-14-12/h2-8H,13H2,1H3
InChIKeyYNHBISGORKMJEC-UHFFFAOYSA-N
XLogP3.12
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.31
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-methyl-6-(2-methylphenyl)sulfanylpyridin-3-amine
CID 79176562
1-[6-(2-methylphenyl)sulfanyl-3-pyridinyl]propan-2-amine
CID 80651384
6-methylsulfanylpyridin-3-amine
CID 10261179
6-(4-methylpyrimidin-2-yl)sulfanylpyridin-3-amine
CID 62267843
6-(2-methylphenyl)sulfanyl-2-propoxypyridin-3-amine
CID 63537893
6-(2,3,4,5,6-pentachlorophenyl)sulfanylpyridin-3-amine
CID 56697110
6-hydroxysulfanylpyridin-3-amine
CID 142417119
6-(2,5-dimethylpyrazol-3-yl)sulfanylpyridin-3-amine
CID 62409540
4-methoxy-6-(2-methylphenyl)sulfanylpyrimidin-2-amine
CID 114053340
2-chloro-4-(2-methylphenyl)sulfanylpyrimidine
CID 62342676
3-(difluoromethyl)-4-(2-methylphenyl)sulfanylaniline
CID 63735518
1-[(5-amino-2-pyridinyl)sulfanyl]butan-2-ol
CID 60885424

Frequently Asked Questions

What is the IUPAC name of 6-(2-methylphenyl)sulfanylpyridin-3-amine?
The IUPAC name of 6-(2-methylphenyl)sulfanylpyridin-3-amine (CID 901270) is 6-(2-methylphenyl)sulfanylpyridin-3-amine.
What is the SMILES notation for 6-(2-methylphenyl)sulfanylpyridin-3-amine?
The canonical SMILES for 6-(2-methylphenyl)sulfanylpyridin-3-amine is Cc1ccccc1Sc1ccc(N)cn1.
What is the InChIKey of 6-(2-methylphenyl)sulfanylpyridin-3-amine?
The InChIKey is YNHBISGORKMJEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2S/c1-9-4-2-3-5-11(9)15-12-7-6-10(13)8-14-12/h2-8H,13H2,1H3.
What are the key properties of 6-(2-methylphenyl)sulfanylpyridin-3-amine?
6-(2-methylphenyl)sulfanylpyridin-3-amine has a molecular weight of 216.31 g/mol, XLogP of 3.12, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methylphenyl)sulfanylpyridin-3-amine is sourced from PubChem (CID 901270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).