2-[(1R)-1-[(1R)-1-thiophen-2-ylprop-2-enyl]sulfanylprop-2-enyl]thiophene

C14H14S3 — CID 141305059

IUPAC2-[(1R)-1-[(1R)-1-thiophen-2-ylprop-2-enyl]sulfanylprop-2-enyl]thiophene
SMILESC=C[C@@H](S[C@H](C=C)c1cccs1)c1cccs1
InChIInChI=1S/C14H14S3/c1-3-11(13-7-5-9-15-13)17-12(4-2)14-8-6-10-16-14/h3-12H,1-2H2/t11-,12-/m1/s1
InChIKeyACKJMDGEHFSKQZ-VXGBXAGGSA-N
MW278.47 g/mol
LogP5.70
Rot. Bonds6

About 2-[(1R)-1-[(1R)-1-thiophen-2-ylprop-2-enyl]sulfanylprop-2-enyl]thiophene

2-[(1R)-1-[(1R)-1-thiophen-2-ylprop-2-enyl]sulfanylprop-2-enyl]thiophene (PubChem CID 141305059) has the molecular formula C14H14S3 and a molecular weight of 278.47 g/mol. Its IUPAC name is 2-[(1R)-1-[(1R)-1-thiophen-2-ylprop-2-enyl]sulfanylprop-2-enyl]thiophene.

Molecular Properties

Compound Name2-[(1R)-1-[(1R)-1-thiophen-2-ylprop-2-enyl]sulfanylprop-2-enyl]thiophene
PubChem CID141305059
Molecular FormulaC14H14S3
Molecular Weight278.47 g/mol
Exact Mass278.03
IUPAC Name2-[(1R)-1-[(1R)-1-thiophen-2-ylprop-2-enyl]sulfanylprop-2-enyl]thiophene
SMILESC=C[C@@H](S[C@H](C=C)c1cccs1)c1cccs1
InChIInChI=1S/C14H14S3/c1-3-11(13-7-5-9-15-13)17-12(4-2)14-8-6-10-16-14/h3-12H,1-2H2/t11-,12-/m1/s1
InChIKeyACKJMDGEHFSKQZ-VXGBXAGGSA-N
XLogP5.70
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500278.47
LogP ≤ 55.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[(1R)-1-[(1R)-1-thiophen-2-ylprop-2-enyl]sulfanylprop-2-enyl]thiophene?
The IUPAC name of 2-[(1R)-1-[(1R)-1-thiophen-2-ylprop-2-enyl]sulfanylprop-2-enyl]thiophene (CID 141305059) is 2-[(1R)-1-[(1R)-1-thiophen-2-ylprop-2-enyl]sulfanylprop-2-enyl]thiophene.
What is the SMILES notation for 2-[(1R)-1-[(1R)-1-thiophen-2-ylprop-2-enyl]sulfanylprop-2-enyl]thiophene?
The canonical SMILES for 2-[(1R)-1-[(1R)-1-thiophen-2-ylprop-2-enyl]sulfanylprop-2-enyl]thiophene is C=C[C@@H](S[C@H](C=C)c1cccs1)c1cccs1.
What is the InChIKey of 2-[(1R)-1-[(1R)-1-thiophen-2-ylprop-2-enyl]sulfanylprop-2-enyl]thiophene?
The InChIKey is ACKJMDGEHFSKQZ-VXGBXAGGSA-N. The full InChI is InChI=1S/C14H14S3/c1-3-11(13-7-5-9-15-13)17-12(4-2)14-8-6-10-16-14/h3-12H,1-2H2/t11-,12-/m1/s1.
What are the key properties of 2-[(1R)-1-[(1R)-1-thiophen-2-ylprop-2-enyl]sulfanylprop-2-enyl]thiophene?
2-[(1R)-1-[(1R)-1-thiophen-2-ylprop-2-enyl]sulfanylprop-2-enyl]thiophene has a molecular weight of 278.47 g/mol, XLogP of 5.70, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1R)-1-[(1R)-1-thiophen-2-ylprop-2-enyl]sulfanylprop-2-enyl]thiophene is sourced from PubChem (CID 141305059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).