(2-phenylindolizin-3-yl)-thiophen-2-ylmethanone

C19H13NOS — CID 2322670

IUPAC(2-phenylindolizin-3-yl)-thiophen-2-ylmethanone
SMILESO=C(c1cccs1)c1c(-c2ccccc2)cc2ccccn12
InChIInChI=1S/C19H13NOS/c21-19(17-10-6-12-22-17)18-16(14-7-2-1-3-8-14)13-15-9-4-5-11-20(15)18/h1-13H
InChIKeyHFTJMJBGGCWWLG-UHFFFAOYSA-N
MW303.39 g/mol
LogP4.90
Rot. Bonds3

About (2-phenylindolizin-3-yl)-thiophen-2-ylmethanone

(2-phenylindolizin-3-yl)-thiophen-2-ylmethanone (PubChem CID 2322670) has the molecular formula C19H13NOS and a molecular weight of 303.39 g/mol. Its IUPAC name is (2-phenylindolizin-3-yl)-thiophen-2-ylmethanone.

Molecular Properties

Compound Name(2-phenylindolizin-3-yl)-thiophen-2-ylmethanone
PubChem CID2322670
Molecular FormulaC19H13NOS
Molecular Weight303.39 g/mol
Exact Mass303.07
IUPAC Name(2-phenylindolizin-3-yl)-thiophen-2-ylmethanone
SMILESO=C(c1cccs1)c1c(-c2ccccc2)cc2ccccn12
InChIInChI=1S/C19H13NOS/c21-19(17-10-6-12-22-17)18-16(14-7-2-1-3-8-14)13-15-9-4-5-11-20(15)18/h1-13H
InChIKeyHFTJMJBGGCWWLG-UHFFFAOYSA-N
XLogP4.90
TPSA21.48 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.39
LogP ≤ 54.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2-phenylindolizin-3-yl)-thiophen-2-ylmethanone?
The IUPAC name of (2-phenylindolizin-3-yl)-thiophen-2-ylmethanone (CID 2322670) is (2-phenylindolizin-3-yl)-thiophen-2-ylmethanone.
What is the SMILES notation for (2-phenylindolizin-3-yl)-thiophen-2-ylmethanone?
The canonical SMILES for (2-phenylindolizin-3-yl)-thiophen-2-ylmethanone is O=C(c1cccs1)c1c(-c2ccccc2)cc2ccccn12.
What is the InChIKey of (2-phenylindolizin-3-yl)-thiophen-2-ylmethanone?
The InChIKey is HFTJMJBGGCWWLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13NOS/c21-19(17-10-6-12-22-17)18-16(14-7-2-1-3-8-14)13-15-9-4-5-11-20(15)18/h1-13H.
What are the key properties of (2-phenylindolizin-3-yl)-thiophen-2-ylmethanone?
(2-phenylindolizin-3-yl)-thiophen-2-ylmethanone has a molecular weight of 303.39 g/mol, XLogP of 4.90, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-phenylindolizin-3-yl)-thiophen-2-ylmethanone is sourced from PubChem (CID 2322670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).