3-amino-3-([1,3]thiazolo[5,4-b]pyridin-2-yl)propan-1-ol

C9H11N3OS — CID 65335836

IUPAC3-amino-3-([1,3]thiazolo[5,4-b]pyridin-2-yl)propan-1-ol
SMILESNC(CCO)c1nc2cccnc2s1
InChIInChI=1S/C9H11N3OS/c10-6(3-5-13)8-12-7-2-1-4-11-9(7)14-8/h1-2,4,6,13H,3,5,10H2
InChIKeyIBHNBCUCFSKNRI-UHFFFAOYSA-N
MW209.27 g/mol
LogP1.07
Rot. Bonds3

About 3-amino-3-([1,3]thiazolo[5,4-b]pyridin-2-yl)propan-1-ol

3-amino-3-([1,3]thiazolo[5,4-b]pyridin-2-yl)propan-1-ol (PubChem CID 65335836) has the molecular formula C9H11N3OS and a molecular weight of 209.27 g/mol. Its IUPAC name is 3-amino-3-([1,3]thiazolo[5,4-b]pyridin-2-yl)propan-1-ol.

Molecular Properties

Compound Name3-amino-3-([1,3]thiazolo[5,4-b]pyridin-2-yl)propan-1-ol
PubChem CID65335836
Molecular FormulaC9H11N3OS
Molecular Weight209.27 g/mol
Exact Mass209.06
IUPAC Name3-amino-3-([1,3]thiazolo[5,4-b]pyridin-2-yl)propan-1-ol
SMILESNC(CCO)c1nc2cccnc2s1
InChIInChI=1S/C9H11N3OS/c10-6(3-5-13)8-12-7-2-1-4-11-9(7)14-8/h1-2,4,6,13H,3,5,10H2
InChIKeyIBHNBCUCFSKNRI-UHFFFAOYSA-N
XLogP1.07
TPSA72.03 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.27
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-amino-3-([1,3]thiazolo[5,4-b]pyridin-2-yl)propan-1-ol?
The IUPAC name of 3-amino-3-([1,3]thiazolo[5,4-b]pyridin-2-yl)propan-1-ol (CID 65335836) is 3-amino-3-([1,3]thiazolo[5,4-b]pyridin-2-yl)propan-1-ol.
What is the SMILES notation for 3-amino-3-([1,3]thiazolo[5,4-b]pyridin-2-yl)propan-1-ol?
The canonical SMILES for 3-amino-3-([1,3]thiazolo[5,4-b]pyridin-2-yl)propan-1-ol is NC(CCO)c1nc2cccnc2s1.
What is the InChIKey of 3-amino-3-([1,3]thiazolo[5,4-b]pyridin-2-yl)propan-1-ol?
The InChIKey is IBHNBCUCFSKNRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3OS/c10-6(3-5-13)8-12-7-2-1-4-11-9(7)14-8/h1-2,4,6,13H,3,5,10H2.
What are the key properties of 3-amino-3-([1,3]thiazolo[5,4-b]pyridin-2-yl)propan-1-ol?
3-amino-3-([1,3]thiazolo[5,4-b]pyridin-2-yl)propan-1-ol has a molecular weight of 209.27 g/mol, XLogP of 1.07, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-3-([1,3]thiazolo[5,4-b]pyridin-2-yl)propan-1-ol is sourced from PubChem (CID 65335836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).