5-(pyridin-2-ylsulfanylmethyl)-1,3-thiazol-2-amine

C9H9N3S2 — CID 79774891

IUPAC5-(pyridin-2-ylsulfanylmethyl)-1,3-thiazol-2-amine
SMILESNc1ncc(CSc2ccccn2)s1
InChIInChI=1S/C9H9N3S2/c10-9-12-5-7(14-9)6-13-8-3-1-2-4-11-8/h1-5H,6H2,(H2,10,12)
InChIKeyOWFOVOMLZBWMQE-UHFFFAOYSA-N
MW223.33 g/mol
LogP2.41
Rot. Bonds3

About 5-(pyridin-2-ylsulfanylmethyl)-1,3-thiazol-2-amine

5-(pyridin-2-ylsulfanylmethyl)-1,3-thiazol-2-amine (PubChem CID 79774891) has the molecular formula C9H9N3S2 and a molecular weight of 223.33 g/mol. Its IUPAC name is 5-(pyridin-2-ylsulfanylmethyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-(pyridin-2-ylsulfanylmethyl)-1,3-thiazol-2-amine
PubChem CID79774891
Molecular FormulaC9H9N3S2
Molecular Weight223.33 g/mol
Exact Mass223.02
IUPAC Name5-(pyridin-2-ylsulfanylmethyl)-1,3-thiazol-2-amine
SMILESNc1ncc(CSc2ccccn2)s1
InChIInChI=1S/C9H9N3S2/c10-9-12-5-7(14-9)6-13-8-3-1-2-4-11-8/h1-5H,6H2,(H2,10,12)
InChIKeyOWFOVOMLZBWMQE-UHFFFAOYSA-N
XLogP2.41
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.33
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-(pyrimidin-2-ylsulfanylmethyl)-1,3-thiazol-2-amine
CID 79774047
5-(pyridin-2-ylsulfanylmethyl)pyrazin-2-amine
CID 103059734
2-[[2,4,6-trimethyl-3,5-bis(pyridin-2-ylsulfanylmethyl)phenyl]methylsulfanyl]pyridine
CID 11329310
5-[(4,5,6-trimethylpyrimidin-2-yl)sulfanylmethyl]-1,3-thiazol-2-amine
CID 79775190
5-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-1,3-thiazol-2-amine
CID 79774988
6-[(2-methyl-1,3-thiazol-5-yl)methylsulfanyl]pyridin-3-amine
CID 63021346
5-[[methyl(pyridin-2-ylmethyl)amino]methyl]-1,3-thiazol-2-amine;hydrochloride
CID 120902294
5-(pyridin-3-ylmethyl)-1,3-thiazol-2-amine
CID 87629601
2-(pyridin-2-ylsulfanylmethyl)quinazoline
CID 156587667
5-[2-(2-methoxyphenoxy)ethyl]-1,3-thiazol-2-amine
CID 113370258
3-bromo-5-(pyridin-2-ylsulfanylmethyl)pyridine
CID 115580538
pyridin-2-ylsulfanylmethylboronic acid
CID 53216397

Frequently Asked Questions

What is the IUPAC name of 5-(pyridin-2-ylsulfanylmethyl)-1,3-thiazol-2-amine?
The IUPAC name of 5-(pyridin-2-ylsulfanylmethyl)-1,3-thiazol-2-amine (CID 79774891) is 5-(pyridin-2-ylsulfanylmethyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 5-(pyridin-2-ylsulfanylmethyl)-1,3-thiazol-2-amine?
The canonical SMILES for 5-(pyridin-2-ylsulfanylmethyl)-1,3-thiazol-2-amine is Nc1ncc(CSc2ccccn2)s1.
What is the InChIKey of 5-(pyridin-2-ylsulfanylmethyl)-1,3-thiazol-2-amine?
The InChIKey is OWFOVOMLZBWMQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3S2/c10-9-12-5-7(14-9)6-13-8-3-1-2-4-11-8/h1-5H,6H2,(H2,10,12).
What are the key properties of 5-(pyridin-2-ylsulfanylmethyl)-1,3-thiazol-2-amine?
5-(pyridin-2-ylsulfanylmethyl)-1,3-thiazol-2-amine has a molecular weight of 223.33 g/mol, XLogP of 2.41, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(pyridin-2-ylsulfanylmethyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 79774891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).