3-(cyclopenten-1-yl)-1,2-thiazole

C8H9NS — CID 140971456

IUPAC3-(cyclopenten-1-yl)-1,2-thiazole
SMILESC1=C(c2ccsn2)CCC1
InChIInChI=1S/C8H9NS/c1-2-4-7(3-1)8-5-6-10-9-8/h3,5-6H,1-2,4H2
InChIKeyKJIJSBORRGUWEY-UHFFFAOYSA-N
MW151.23 g/mol
LogP2.71
Rot. Bonds1

About 3-(cyclopenten-1-yl)-1,2-thiazole

3-(cyclopenten-1-yl)-1,2-thiazole (PubChem CID 140971456) has the molecular formula C8H9NS and a molecular weight of 151.23 g/mol. Its IUPAC name is 3-(cyclopenten-1-yl)-1,2-thiazole.

Molecular Properties

Compound Name3-(cyclopenten-1-yl)-1,2-thiazole
PubChem CID140971456
Molecular FormulaC8H9NS
Molecular Weight151.23 g/mol
Exact Mass151.05
IUPAC Name3-(cyclopenten-1-yl)-1,2-thiazole
SMILESC1=C(c2ccsn2)CCC1
InChIInChI=1S/C8H9NS/c1-2-4-7(3-1)8-5-6-10-9-8/h3,5-6H,1-2,4H2
InChIKeyKJIJSBORRGUWEY-UHFFFAOYSA-N
XLogP2.71
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.23
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(cyclopenten-1-yl)-1,2-thiazole?
The IUPAC name of 3-(cyclopenten-1-yl)-1,2-thiazole (CID 140971456) is 3-(cyclopenten-1-yl)-1,2-thiazole.
What is the SMILES notation for 3-(cyclopenten-1-yl)-1,2-thiazole?
The canonical SMILES for 3-(cyclopenten-1-yl)-1,2-thiazole is C1=C(c2ccsn2)CCC1.
What is the InChIKey of 3-(cyclopenten-1-yl)-1,2-thiazole?
The InChIKey is KJIJSBORRGUWEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9NS/c1-2-4-7(3-1)8-5-6-10-9-8/h3,5-6H,1-2,4H2.
What are the key properties of 3-(cyclopenten-1-yl)-1,2-thiazole?
3-(cyclopenten-1-yl)-1,2-thiazole has a molecular weight of 151.23 g/mol, XLogP of 2.71, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopenten-1-yl)-1,2-thiazole is sourced from PubChem (CID 140971456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).