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

C10H13N — CID 142984451

IUPAC2,3-bis(ethenyl)-4-ethyl-1H-pyrrole
SMILESC=Cc1[nH]cc(CC)c1C=C
InChIInChI=1S/C10H13N/c1-4-8-7-11-10(6-3)9(8)5-2/h5-7,11H,2-4H2,1H3
InChIKeyFXCBCSMUOQGXTF-UHFFFAOYSA-N
MW147.22 g/mol
LogP2.86
Rot. Bonds3

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

2,3-bis(ethenyl)-4-ethyl-1H-pyrrole (PubChem CID 142984451) has the molecular formula C10H13N and a molecular weight of 147.22 g/mol. Its IUPAC name is 2,3-bis(ethenyl)-4-ethyl-1H-pyrrole.

Molecular Properties

Compound Name2,3-bis(ethenyl)-4-ethyl-1H-pyrrole
PubChem CID142984451
Molecular FormulaC10H13N
Molecular Weight147.22 g/mol
Exact Mass147.10
IUPAC Name2,3-bis(ethenyl)-4-ethyl-1H-pyrrole
SMILESC=Cc1[nH]cc(CC)c1C=C
InChIInChI=1S/C10H13N/c1-4-8-7-11-10(6-3)9(8)5-2/h5-7,11H,2-4H2,1H3
InChIKeyFXCBCSMUOQGXTF-UHFFFAOYSA-N
XLogP2.86
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.22
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

ethane;2-ethenyl-4-ethyl-3-[(Z)-prop-1-enyl]-1H-pyrrole
CID 178090956
ethane;2-ethenyl-3,4-diethyl-1H-pyrrole
CID 177324812
2,3-bis(ethenyl)-4-ethyl-1H-pyrrole;ethane;5-propan-2-yl-1H-imidazole
CID 145088276
4-[4,5-bis(ethenyl)-1H-pyrrol-3-yl]but-1-en-2-amine
CID 144715193
2,3-bis(ethenyl)-5-(hydroxymethyl)-1H-pyridin-4-one
CID 142923204
2,3-bis(ethenyl)-4-methyl-1H-pyrrole;ethane
CID 142006410
2-ethenyl-3-ethyl-1H-pyrrole
CID 144842515
3-[5-ethenyl-4-[(Z)-prop-1-enyl]-1H-pyrrol-3-yl]propan-1-ol
CID 143749630
5-[4-ethenyl-5-[(Z)-prop-1-enyl]-1H-pyrrol-3-yl]pentan-2-one
CID 145421398
2-ethenyl-3,4-dimethyl-1H-pyrrole
CID 144990960
3-[5-ethenyl-4-[(Z)-prop-1-enyl]-1H-pyrrol-3-yl]-2-methyl-2-(methylamino)propan-1-ol
CID 144556832
(3E)-3-(1-bromoprop-2-enylidene)-4-ethyl-2-methylidene-1H-pyrrole
CID 168924796

Frequently Asked Questions

What is the IUPAC name of 2,3-bis(ethenyl)-4-ethyl-1H-pyrrole?
The IUPAC name of 2,3-bis(ethenyl)-4-ethyl-1H-pyrrole (CID 142984451) is 2,3-bis(ethenyl)-4-ethyl-1H-pyrrole.
What is the SMILES notation for 2,3-bis(ethenyl)-4-ethyl-1H-pyrrole?
The canonical SMILES for 2,3-bis(ethenyl)-4-ethyl-1H-pyrrole is C=Cc1[nH]cc(CC)c1C=C.
What is the InChIKey of 2,3-bis(ethenyl)-4-ethyl-1H-pyrrole?
The InChIKey is FXCBCSMUOQGXTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N/c1-4-8-7-11-10(6-3)9(8)5-2/h5-7,11H,2-4H2,1H3.
What are the key properties of 2,3-bis(ethenyl)-4-ethyl-1H-pyrrole?
2,3-bis(ethenyl)-4-ethyl-1H-pyrrole has a molecular weight of 147.22 g/mol, XLogP of 2.86, 3 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-ethyl-1H-pyrrole is sourced from PubChem (CID 142984451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).