2,3-di(cyclopenten-1-yl)thiophene

C14H16S — CID 91052749

IUPAC2,3-di(cyclopenten-1-yl)thiophene
SMILESC1=C(c2ccsc2C2=CCCC2)CCC1
InChIInChI=1S/C14H16S/c1-2-6-11(5-1)13-9-10-15-14(13)12-7-3-4-8-12/h5,7,9-10H,1-4,6,8H2
InChIKeyCGPOCXRWXSZKST-UHFFFAOYSA-N
MW216.35 g/mol
LogP4.88
Rot. Bonds2

About 2,3-di(cyclopenten-1-yl)thiophene

2,3-di(cyclopenten-1-yl)thiophene (PubChem CID 91052749) has the molecular formula C14H16S and a molecular weight of 216.35 g/mol. Its IUPAC name is 2,3-di(cyclopenten-1-yl)thiophene.

Molecular Properties

Compound Name2,3-di(cyclopenten-1-yl)thiophene
PubChem CID91052749
Molecular FormulaC14H16S
Molecular Weight216.35 g/mol
Exact Mass216.10
IUPAC Name2,3-di(cyclopenten-1-yl)thiophene
SMILESC1=C(c2ccsc2C2=CCCC2)CCC1
InChIInChI=1S/C14H16S/c1-2-6-11(5-1)13-9-10-15-14(13)12-7-3-4-8-12/h5,7,9-10H,1-4,6,8H2
InChIKeyCGPOCXRWXSZKST-UHFFFAOYSA-N
XLogP4.88
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.35
LogP ≤ 54.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,3-di(cyclopenten-1-yl)thiophene?
The IUPAC name of 2,3-di(cyclopenten-1-yl)thiophene (CID 91052749) is 2,3-di(cyclopenten-1-yl)thiophene.
What is the SMILES notation for 2,3-di(cyclopenten-1-yl)thiophene?
The canonical SMILES for 2,3-di(cyclopenten-1-yl)thiophene is C1=C(c2ccsc2C2=CCCC2)CCC1.
What is the InChIKey of 2,3-di(cyclopenten-1-yl)thiophene?
The InChIKey is CGPOCXRWXSZKST-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16S/c1-2-6-11(5-1)13-9-10-15-14(13)12-7-3-4-8-12/h5,7,9-10H,1-4,6,8H2.
What are the key properties of 2,3-di(cyclopenten-1-yl)thiophene?
2,3-di(cyclopenten-1-yl)thiophene has a molecular weight of 216.35 g/mol, XLogP of 4.88, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-di(cyclopenten-1-yl)thiophene is sourced from PubChem (CID 91052749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).