1-(1,2-thiazol-3-yl)-2,3,5,6,7,8-hexahydropyrrolizin-1-ol

C10H14N2OS — CID 130841193

IUPAC1-(1,2-thiazol-3-yl)-2,3,5,6,7,8-hexahydropyrrolizin-1-ol
SMILESOC1(c2ccsn2)CCN2CCCC21
InChIInChI=1S/C10H14N2OS/c13-10(8-3-7-14-11-8)4-6-12-5-1-2-9(10)12/h3,7,9,13H,1-2,4-6H2
InChIKeyFVWMYOWAAQPCCA-UHFFFAOYSA-N
MW210.30 g/mol
LogP1.20
Rot. Bonds1

About 1-(1,2-thiazol-3-yl)-2,3,5,6,7,8-hexahydropyrrolizin-1-ol

1-(1,2-thiazol-3-yl)-2,3,5,6,7,8-hexahydropyrrolizin-1-ol (PubChem CID 130841193) has the molecular formula C10H14N2OS and a molecular weight of 210.30 g/mol. Its IUPAC name is 1-(1,2-thiazol-3-yl)-2,3,5,6,7,8-hexahydropyrrolizin-1-ol.

Molecular Properties

Compound Name1-(1,2-thiazol-3-yl)-2,3,5,6,7,8-hexahydropyrrolizin-1-ol
PubChem CID130841193
Molecular FormulaC10H14N2OS
Molecular Weight210.30 g/mol
Exact Mass210.08
IUPAC Name1-(1,2-thiazol-3-yl)-2,3,5,6,7,8-hexahydropyrrolizin-1-ol
SMILESOC1(c2ccsn2)CCN2CCCC21
InChIInChI=1S/C10H14N2OS/c13-10(8-3-7-14-11-8)4-6-12-5-1-2-9(10)12/h3,7,9,13H,1-2,4-6H2
InChIKeyFVWMYOWAAQPCCA-UHFFFAOYSA-N
XLogP1.20
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.30
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-Methyl-3-(1,2-thiazol-3-yl)pyrrolidin-3-ol
CID 130625922
1-(1,2-Thiazol-5-yl)-2,3,5,6,7,8-hexahydropyrrolizin-1-ol
CID 130986278
1-Pyrrolidin-2-yl-1-(1,2-thiazol-3-yl)ethanol
CID 131003149
1-Propyl-3-(1,2-thiazol-3-yl)pyrrolidin-3-ol
CID 131101386

Frequently Asked Questions

What is the IUPAC name of 1-(1,2-thiazol-3-yl)-2,3,5,6,7,8-hexahydropyrrolizin-1-ol?
The IUPAC name of 1-(1,2-thiazol-3-yl)-2,3,5,6,7,8-hexahydropyrrolizin-1-ol (CID 130841193) is 1-(1,2-thiazol-3-yl)-2,3,5,6,7,8-hexahydropyrrolizin-1-ol.
What is the SMILES notation for 1-(1,2-thiazol-3-yl)-2,3,5,6,7,8-hexahydropyrrolizin-1-ol?
The canonical SMILES for 1-(1,2-thiazol-3-yl)-2,3,5,6,7,8-hexahydropyrrolizin-1-ol is OC1(c2ccsn2)CCN2CCCC21.
What is the InChIKey of 1-(1,2-thiazol-3-yl)-2,3,5,6,7,8-hexahydropyrrolizin-1-ol?
The InChIKey is FVWMYOWAAQPCCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2OS/c13-10(8-3-7-14-11-8)4-6-12-5-1-2-9(10)12/h3,7,9,13H,1-2,4-6H2.
What are the key properties of 1-(1,2-thiazol-3-yl)-2,3,5,6,7,8-hexahydropyrrolizin-1-ol?
1-(1,2-thiazol-3-yl)-2,3,5,6,7,8-hexahydropyrrolizin-1-ol has a molecular weight of 210.30 g/mol, XLogP of 1.20, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,2-thiazol-3-yl)-2,3,5,6,7,8-hexahydropyrrolizin-1-ol is sourced from PubChem (CID 130841193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).