5-methyl-2-(1-methylpyrazol-4-yl)sulfanylpyridin-3-amine

C10H12N4S — CID 66280911

IUPAC5-methyl-2-(1-methylpyrazol-4-yl)sulfanylpyridin-3-amine
SMILESCc1cnc(Sc2cnn(C)c2)c(N)c1
InChIInChI=1S/C10H12N4S/c1-7-3-9(11)10(12-4-7)15-8-5-13-14(2)6-8/h3-6H,11H2,1-2H3
InChIKeyVAEANGDYURANOF-UHFFFAOYSA-N
MW220.30 g/mol
LogP1.86
Rot. Bonds2

About 5-methyl-2-(1-methylpyrazol-4-yl)sulfanylpyridin-3-amine

5-methyl-2-(1-methylpyrazol-4-yl)sulfanylpyridin-3-amine (PubChem CID 66280911) has the molecular formula C10H12N4S and a molecular weight of 220.30 g/mol. Its IUPAC name is 5-methyl-2-(1-methylpyrazol-4-yl)sulfanylpyridin-3-amine.

Molecular Properties

Compound Name5-methyl-2-(1-methylpyrazol-4-yl)sulfanylpyridin-3-amine
PubChem CID66280911
Molecular FormulaC10H12N4S
Molecular Weight220.30 g/mol
Exact Mass220.08
IUPAC Name5-methyl-2-(1-methylpyrazol-4-yl)sulfanylpyridin-3-amine
SMILESCc1cnc(Sc2cnn(C)c2)c(N)c1
InChIInChI=1S/C10H12N4S/c1-7-3-9(11)10(12-4-7)15-8-5-13-14(2)6-8/h3-6H,11H2,1-2H3
InChIKeyVAEANGDYURANOF-UHFFFAOYSA-N
XLogP1.86
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.30
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(1-methylpyrazol-4-yl)sulfanylaniline
CID 61384658
5-ethyl-6-(1-methylpyrazol-4-yl)sulfanylpyrimidin-4-amine
CID 80892560
6-methoxy-2-(1-methylpyrazol-4-yl)sulfanylpyridin-3-amine
CID 115321381
2-(3-methoxyphenyl)sulfanyl-5-methylpyridin-3-amine
CID 66280907
4-bromo-2-(1-methylpyrazol-4-yl)sulfanylaniline
CID 65342219
5-chloro-2-(1-methylpyrazol-4-yl)sulfanylaniline
CID 61384655
5-methyl-2-N-[2-(1-methylpyrazol-4-yl)ethyl]pyridine-2,3-diamine
CID 80681081
8-(1-methylpyrazol-4-yl)sulfanylimidazo[1,2-a]pyrazin-6-amine
CID 80892709
6-(1-methylpyrazol-4-yl)sulfanylpyrimidine-2,4-diamine
CID 80892034
S-(1-methylpyrazol-4-yl)thiohydroxylamine
CID 134606246
[5-methyl-2-(1-methylpyrazol-4-yl)sulfanylphenyl]methanamine
CID 107931460
5-methyl-2-(oxetan-3-ylsulfanyl)pyridin-3-amine
CID 79326602

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-(1-methylpyrazol-4-yl)sulfanylpyridin-3-amine?
The IUPAC name of 5-methyl-2-(1-methylpyrazol-4-yl)sulfanylpyridin-3-amine (CID 66280911) is 5-methyl-2-(1-methylpyrazol-4-yl)sulfanylpyridin-3-amine.
What is the SMILES notation for 5-methyl-2-(1-methylpyrazol-4-yl)sulfanylpyridin-3-amine?
The canonical SMILES for 5-methyl-2-(1-methylpyrazol-4-yl)sulfanylpyridin-3-amine is Cc1cnc(Sc2cnn(C)c2)c(N)c1.
What is the InChIKey of 5-methyl-2-(1-methylpyrazol-4-yl)sulfanylpyridin-3-amine?
The InChIKey is VAEANGDYURANOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4S/c1-7-3-9(11)10(12-4-7)15-8-5-13-14(2)6-8/h3-6H,11H2,1-2H3.
What are the key properties of 5-methyl-2-(1-methylpyrazol-4-yl)sulfanylpyridin-3-amine?
5-methyl-2-(1-methylpyrazol-4-yl)sulfanylpyridin-3-amine has a molecular weight of 220.30 g/mol, XLogP of 1.86, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-(1-methylpyrazol-4-yl)sulfanylpyridin-3-amine is sourced from PubChem (CID 66280911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).