6-[(2-methyl-1,3-thiazol-5-yl)methylsulfanyl]pyridin-3-amine

C10H11N3S2 — CID 63021346

IUPAC6-[(2-methyl-1,3-thiazol-5-yl)methylsulfanyl]pyridin-3-amine
SMILESCc1ncc(CSc2ccc(N)cn2)s1
InChIInChI=1S/C10H11N3S2/c1-7-12-5-9(15-7)6-14-10-3-2-8(11)4-13-10/h2-5H,6,11H2,1H3
InChIKeyOSFIWGASOWDSHA-UHFFFAOYSA-N
MW237.35 g/mol
LogP2.72
Rot. Bonds3

About 6-[(2-methyl-1,3-thiazol-5-yl)methylsulfanyl]pyridin-3-amine

6-[(2-methyl-1,3-thiazol-5-yl)methylsulfanyl]pyridin-3-amine (PubChem CID 63021346) has the molecular formula C10H11N3S2 and a molecular weight of 237.35 g/mol. Its IUPAC name is 6-[(2-methyl-1,3-thiazol-5-yl)methylsulfanyl]pyridin-3-amine.

Molecular Properties

Compound Name6-[(2-methyl-1,3-thiazol-5-yl)methylsulfanyl]pyridin-3-amine
PubChem CID63021346
Molecular FormulaC10H11N3S2
Molecular Weight237.35 g/mol
Exact Mass237.04
IUPAC Name6-[(2-methyl-1,3-thiazol-5-yl)methylsulfanyl]pyridin-3-amine
SMILESCc1ncc(CSc2ccc(N)cn2)s1
InChIInChI=1S/C10H11N3S2/c1-7-12-5-9(15-7)6-14-10-3-2-8(11)4-13-10/h2-5H,6,11H2,1H3
InChIKeyOSFIWGASOWDSHA-UHFFFAOYSA-N
XLogP2.72
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-[(2-methyl-1,3-thiazol-5-yl)methylsulfanyl]pyridin-3-amine?
The IUPAC name of 6-[(2-methyl-1,3-thiazol-5-yl)methylsulfanyl]pyridin-3-amine (CID 63021346) is 6-[(2-methyl-1,3-thiazol-5-yl)methylsulfanyl]pyridin-3-amine.
What is the SMILES notation for 6-[(2-methyl-1,3-thiazol-5-yl)methylsulfanyl]pyridin-3-amine?
The canonical SMILES for 6-[(2-methyl-1,3-thiazol-5-yl)methylsulfanyl]pyridin-3-amine is Cc1ncc(CSc2ccc(N)cn2)s1.
What is the InChIKey of 6-[(2-methyl-1,3-thiazol-5-yl)methylsulfanyl]pyridin-3-amine?
The InChIKey is OSFIWGASOWDSHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3S2/c1-7-12-5-9(15-7)6-14-10-3-2-8(11)4-13-10/h2-5H,6,11H2,1H3.
What are the key properties of 6-[(2-methyl-1,3-thiazol-5-yl)methylsulfanyl]pyridin-3-amine?
6-[(2-methyl-1,3-thiazol-5-yl)methylsulfanyl]pyridin-3-amine has a molecular weight of 237.35 g/mol, XLogP of 2.72, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2-methyl-1,3-thiazol-5-yl)methylsulfanyl]pyridin-3-amine is sourced from PubChem (CID 63021346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).