1-[7-(methylamino)-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethanol

C8H10N4OS — CID 131054103

IUPAC1-[7-(methylamino)-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethanol
SMILESCNc1ncnc2sc(C(C)O)nc12
InChIInChI=1S/C8H10N4OS/c1-4(13)7-12-5-6(9-2)10-3-11-8(5)14-7/h3-4,13H,1-2H3,(H,9,10,11)
InChIKeyYJRLRVHSOFCKGM-UHFFFAOYSA-N
MW210.26 g/mol
LogP1.18
Rot. Bonds2

About 1-[7-(methylamino)-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethanol

1-[7-(methylamino)-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethanol (PubChem CID 131054103) has the molecular formula C8H10N4OS and a molecular weight of 210.26 g/mol. Its IUPAC name is 1-[7-(methylamino)-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethanol.

Molecular Properties

Compound Name1-[7-(methylamino)-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethanol
PubChem CID131054103
Molecular FormulaC8H10N4OS
Molecular Weight210.26 g/mol
Exact Mass210.06
IUPAC Name1-[7-(methylamino)-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethanol
SMILESCNc1ncnc2sc(C(C)O)nc12
InChIInChI=1S/C8H10N4OS/c1-4(13)7-12-5-6(9-2)10-3-11-8(5)14-7/h3-4,13H,1-2H3,(H,9,10,11)
InChIKeyYJRLRVHSOFCKGM-UHFFFAOYSA-N
XLogP1.18
TPSA70.93 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.26
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-[7-(methylamino)-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethanol?
The IUPAC name of 1-[7-(methylamino)-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethanol (CID 131054103) is 1-[7-(methylamino)-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethanol.
What is the SMILES notation for 1-[7-(methylamino)-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethanol?
The canonical SMILES for 1-[7-(methylamino)-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethanol is CNc1ncnc2sc(C(C)O)nc12.
What is the InChIKey of 1-[7-(methylamino)-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethanol?
The InChIKey is YJRLRVHSOFCKGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4OS/c1-4(13)7-12-5-6(9-2)10-3-11-8(5)14-7/h3-4,13H,1-2H3,(H,9,10,11).
What are the key properties of 1-[7-(methylamino)-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethanol?
1-[7-(methylamino)-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethanol has a molecular weight of 210.26 g/mol, XLogP of 1.18, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[7-(methylamino)-[1,3]thiazolo[5,4-d]pyrimidin-2-yl]ethanol is sourced from PubChem (CID 131054103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).