2-[2-(1H-pyrrol-2-yl)ethenyl]-1H-pyrrole

C10H10N2 — CID 67418156

IUPAC2-[2-(1H-pyrrol-2-yl)ethenyl]-1H-pyrrole
SMILESC(=Cc1ccc[nH]1)c1ccc[nH]1
InChIInChI=1S/C10H10N2/c1-3-9(11-7-1)5-6-10-4-2-8-12-10/h1-8,11-12H
InChIKeyRGBYSSAQRIVWCX-UHFFFAOYSA-N
MW158.20 g/mol
LogP2.51
Rot. Bonds2

About 2-[2-(1H-pyrrol-2-yl)ethenyl]-1H-pyrrole

2-[2-(1H-pyrrol-2-yl)ethenyl]-1H-pyrrole (PubChem CID 67418156) has the molecular formula C10H10N2 and a molecular weight of 158.20 g/mol. Its IUPAC name is 2-[2-(1H-pyrrol-2-yl)ethenyl]-1H-pyrrole.

Molecular Properties

Compound Name2-[2-(1H-pyrrol-2-yl)ethenyl]-1H-pyrrole
PubChem CID67418156
Molecular FormulaC10H10N2
Molecular Weight158.20 g/mol
Exact Mass158.08
IUPAC Name2-[2-(1H-pyrrol-2-yl)ethenyl]-1H-pyrrole
SMILESC(=Cc1ccc[nH]1)c1ccc[nH]1
InChIInChI=1S/C10H10N2/c1-3-9(11-7-1)5-6-10-4-2-8-12-10/h1-8,11-12H
InChIKeyRGBYSSAQRIVWCX-UHFFFAOYSA-N
XLogP2.51
TPSA31.58 Ų
H-Bond Donors2
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.20
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(1H-pyrrol-2-yl)ethenyl]-1H-pyrrole?
The IUPAC name of 2-[2-(1H-pyrrol-2-yl)ethenyl]-1H-pyrrole (CID 67418156) is 2-[2-(1H-pyrrol-2-yl)ethenyl]-1H-pyrrole.
What is the SMILES notation for 2-[2-(1H-pyrrol-2-yl)ethenyl]-1H-pyrrole?
The canonical SMILES for 2-[2-(1H-pyrrol-2-yl)ethenyl]-1H-pyrrole is C(=Cc1ccc[nH]1)c1ccc[nH]1.
What is the InChIKey of 2-[2-(1H-pyrrol-2-yl)ethenyl]-1H-pyrrole?
The InChIKey is RGBYSSAQRIVWCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2/c1-3-9(11-7-1)5-6-10-4-2-8-12-10/h1-8,11-12H.
What are the key properties of 2-[2-(1H-pyrrol-2-yl)ethenyl]-1H-pyrrole?
2-[2-(1H-pyrrol-2-yl)ethenyl]-1H-pyrrole has a molecular weight of 158.20 g/mol, XLogP of 2.51, 2 rotatable bonds, 2 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(1H-pyrrol-2-yl)ethenyl]-1H-pyrrole is sourced from PubChem (CID 67418156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).