4-ethyl-2-methylcyclopenta[b]pyrrole

C10H11N — CID 91121475

IUPAC4-ethyl-2-methylcyclopenta[b]pyrrole
SMILESCCC1=C2C=C(C)N=C2C=C1
InChIInChI=1S/C10H11N/c1-3-8-4-5-10-9(8)6-7(2)11-10/h4-6H,3H2,1-2H3
InChIKeyHPJMSLIYCXREIG-UHFFFAOYSA-N
MW145.20 g/mol
LogP2.62
Rot. Bonds1

About 4-ethyl-2-methylcyclopenta[b]pyrrole

4-ethyl-2-methylcyclopenta[b]pyrrole (PubChem CID 91121475) has the molecular formula C10H11N and a molecular weight of 145.20 g/mol. Its IUPAC name is 4-ethyl-2-methylcyclopenta[b]pyrrole.

Molecular Properties

Compound Name4-ethyl-2-methylcyclopenta[b]pyrrole
PubChem CID91121475
Molecular FormulaC10H11N
Molecular Weight145.20 g/mol
Exact Mass145.09
IUPAC Name4-ethyl-2-methylcyclopenta[b]pyrrole
SMILESCCC1=C2C=C(C)N=C2C=C1
InChIInChI=1S/C10H11N/c1-3-8-4-5-10-9(8)6-7(2)11-10/h4-6H,3H2,1-2H3
InChIKeyHPJMSLIYCXREIG-UHFFFAOYSA-N
XLogP2.62
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2-methylcyclopenta[b]pyrrole?
The IUPAC name of 4-ethyl-2-methylcyclopenta[b]pyrrole (CID 91121475) is 4-ethyl-2-methylcyclopenta[b]pyrrole.
What is the SMILES notation for 4-ethyl-2-methylcyclopenta[b]pyrrole?
The canonical SMILES for 4-ethyl-2-methylcyclopenta[b]pyrrole is CCC1=C2C=C(C)N=C2C=C1.
What is the InChIKey of 4-ethyl-2-methylcyclopenta[b]pyrrole?
The InChIKey is HPJMSLIYCXREIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N/c1-3-8-4-5-10-9(8)6-7(2)11-10/h4-6H,3H2,1-2H3.
What are the key properties of 4-ethyl-2-methylcyclopenta[b]pyrrole?
4-ethyl-2-methylcyclopenta[b]pyrrole has a molecular weight of 145.20 g/mol, XLogP of 2.62, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-methylcyclopenta[b]pyrrole is sourced from PubChem (CID 91121475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).