2,3-bis(ethenyl)-4,5-dimethylidene-1H-pyrrole

C10H11N — CID 144687352

IUPAC2,3-bis(ethenyl)-4,5-dimethylidene-1H-pyrrole
SMILESC=Cc1[nH]c(=C)c(=C)c1C=C
InChIInChI=1S/C10H11N/c1-5-9-7(3)8(4)11-10(9)6-2/h5-6,11H,1-4H2
InChIKeyCQKOBZDAZUDWAV-UHFFFAOYSA-N
MW145.20 g/mol
LogP1.12
Rot. Bonds2

About 2,3-bis(ethenyl)-4,5-dimethylidene-1H-pyrrole

2,3-bis(ethenyl)-4,5-dimethylidene-1H-pyrrole (PubChem CID 144687352) has the molecular formula C10H11N and a molecular weight of 145.20 g/mol. Its IUPAC name is 2,3-bis(ethenyl)-4,5-dimethylidene-1H-pyrrole.

Molecular Properties

Compound Name2,3-bis(ethenyl)-4,5-dimethylidene-1H-pyrrole
PubChem CID144687352
Molecular FormulaC10H11N
Molecular Weight145.20 g/mol
Exact Mass145.09
IUPAC Name2,3-bis(ethenyl)-4,5-dimethylidene-1H-pyrrole
SMILESC=Cc1[nH]c(=C)c(=C)c1C=C
InChIInChI=1S/C10H11N/c1-5-9-7(3)8(4)11-10(9)6-2/h5-6,11H,1-4H2
InChIKeyCQKOBZDAZUDWAV-UHFFFAOYSA-N
XLogP1.12
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2,3-bis(ethenyl)-4,5-dimethylidene-1H-pyrrole?
The IUPAC name of 2,3-bis(ethenyl)-4,5-dimethylidene-1H-pyrrole (CID 144687352) is 2,3-bis(ethenyl)-4,5-dimethylidene-1H-pyrrole.
What is the SMILES notation for 2,3-bis(ethenyl)-4,5-dimethylidene-1H-pyrrole?
The canonical SMILES for 2,3-bis(ethenyl)-4,5-dimethylidene-1H-pyrrole is C=Cc1[nH]c(=C)c(=C)c1C=C.
What is the InChIKey of 2,3-bis(ethenyl)-4,5-dimethylidene-1H-pyrrole?
The InChIKey is CQKOBZDAZUDWAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N/c1-5-9-7(3)8(4)11-10(9)6-2/h5-6,11H,1-4H2.
What are the key properties of 2,3-bis(ethenyl)-4,5-dimethylidene-1H-pyrrole?
2,3-bis(ethenyl)-4,5-dimethylidene-1H-pyrrole has a molecular weight of 145.20 g/mol, XLogP of 1.12, 2 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-bis(ethenyl)-4,5-dimethylidene-1H-pyrrole is sourced from PubChem (CID 144687352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).