2-(cyclopenten-1-yl)-4,5-dihydro-1,3-thiazole

C8H11NS — CID 175262952

IUPAC2-(cyclopenten-1-yl)-4,5-dihydro-1,3-thiazole
SMILESC1=C(C2=NCCS2)CCC1
InChIInChI=1S/C8H11NS/c1-2-4-7(3-1)8-9-5-6-10-8/h3H,1-2,4-6H2
InChIKeyPORCXSYESIPCDH-UHFFFAOYSA-N
MW153.25 g/mol
LogP2.24
Rot. Bonds1

About 2-(cyclopenten-1-yl)-4,5-dihydro-1,3-thiazole

2-(cyclopenten-1-yl)-4,5-dihydro-1,3-thiazole (PubChem CID 175262952) has the molecular formula C8H11NS and a molecular weight of 153.25 g/mol. Its IUPAC name is 2-(cyclopenten-1-yl)-4,5-dihydro-1,3-thiazole.

Molecular Properties

Compound Name2-(cyclopenten-1-yl)-4,5-dihydro-1,3-thiazole
PubChem CID175262952
Molecular FormulaC8H11NS
Molecular Weight153.25 g/mol
Exact Mass153.06
IUPAC Name2-(cyclopenten-1-yl)-4,5-dihydro-1,3-thiazole
SMILESC1=C(C2=NCCS2)CCC1
InChIInChI=1S/C8H11NS/c1-2-4-7(3-1)8-9-5-6-10-8/h3H,1-2,4-6H2
InChIKeyPORCXSYESIPCDH-UHFFFAOYSA-N
XLogP2.24
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.25
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclopenten-1-yl)-4,5-dihydro-1,3-thiazole?
The IUPAC name of 2-(cyclopenten-1-yl)-4,5-dihydro-1,3-thiazole (CID 175262952) is 2-(cyclopenten-1-yl)-4,5-dihydro-1,3-thiazole.
What is the SMILES notation for 2-(cyclopenten-1-yl)-4,5-dihydro-1,3-thiazole?
The canonical SMILES for 2-(cyclopenten-1-yl)-4,5-dihydro-1,3-thiazole is C1=C(C2=NCCS2)CCC1.
What is the InChIKey of 2-(cyclopenten-1-yl)-4,5-dihydro-1,3-thiazole?
The InChIKey is PORCXSYESIPCDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NS/c1-2-4-7(3-1)8-9-5-6-10-8/h3H,1-2,4-6H2.
What are the key properties of 2-(cyclopenten-1-yl)-4,5-dihydro-1,3-thiazole?
2-(cyclopenten-1-yl)-4,5-dihydro-1,3-thiazole has a molecular weight of 153.25 g/mol, XLogP of 2.24, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopenten-1-yl)-4,5-dihydro-1,3-thiazole is sourced from PubChem (CID 175262952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).