1-thiophen-3-ylpyrrole

C8H7NS — CID 2767941

IUPAC1-thiophen-3-ylpyrrole
SMILESc1ccn(-c2ccsc2)c1
InChIInChI=1S/C8H7NS/c1-2-5-9(4-1)8-3-6-10-7-8/h1-7H
InChIKeyMEBVOSFXOANTOP-UHFFFAOYSA-N
MW149.22 g/mol
LogP2.54
Rot. Bonds1

About 1-thiophen-3-ylpyrrole

1-thiophen-3-ylpyrrole (PubChem CID 2767941) has the molecular formula C8H7NS and a molecular weight of 149.22 g/mol. Its IUPAC name is 1-thiophen-3-ylpyrrole.

Molecular Properties

Compound Name1-thiophen-3-ylpyrrole
PubChem CID2767941
Molecular FormulaC8H7NS
Molecular Weight149.22 g/mol
Exact Mass149.03
IUPAC Name1-thiophen-3-ylpyrrole
SMILESc1ccn(-c2ccsc2)c1
InChIInChI=1S/C8H7NS/c1-2-5-9(4-1)8-3-6-10-7-8/h1-7H
InChIKeyMEBVOSFXOANTOP-UHFFFAOYSA-N
XLogP2.54
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.22
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-thiophen-3-ylpyrrole?
The IUPAC name of 1-thiophen-3-ylpyrrole (CID 2767941) is 1-thiophen-3-ylpyrrole.
What is the SMILES notation for 1-thiophen-3-ylpyrrole?
The canonical SMILES for 1-thiophen-3-ylpyrrole is c1ccn(-c2ccsc2)c1.
What is the InChIKey of 1-thiophen-3-ylpyrrole?
The InChIKey is MEBVOSFXOANTOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7NS/c1-2-5-9(4-1)8-3-6-10-7-8/h1-7H.
What are the key properties of 1-thiophen-3-ylpyrrole?
1-thiophen-3-ylpyrrole has a molecular weight of 149.22 g/mol, XLogP of 2.54, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-thiophen-3-ylpyrrole is sourced from PubChem (CID 2767941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).