2,3-dihydro-1H-cyclopenta[b]pyrrole

C7H7N — CID 90192716

IUPAC2,3-dihydro-1H-cyclopenta[b]pyrrole
SMILESC1=CC=C2CCNC=12
InChIInChI=1S/C7H7N/c1-2-6-4-5-8-7(6)3-1/h1-2,8H,4-5H2
InChIKeyNXBVAMIYYSQGBW-UHFFFAOYSA-N
MW105.14 g/mol
LogP0.96
Rot. Bonds

About 2,3-dihydro-1H-cyclopenta[b]pyrrole

2,3-dihydro-1H-cyclopenta[b]pyrrole (PubChem CID 90192716) has the molecular formula C7H7N and a molecular weight of 105.14 g/mol. Its IUPAC name is 2,3-dihydro-1H-cyclopenta[b]pyrrole.

Molecular Properties

Compound Name2,3-dihydro-1H-cyclopenta[b]pyrrole
PubChem CID90192716
Molecular FormulaC7H7N
Molecular Weight105.14 g/mol
Exact Mass105.06
IUPAC Name2,3-dihydro-1H-cyclopenta[b]pyrrole
SMILESC1=CC=C2CCNC=12
InChIInChI=1S/C7H7N/c1-2-6-4-5-8-7(6)3-1/h1-2,8H,4-5H2
InChIKeyNXBVAMIYYSQGBW-UHFFFAOYSA-N
XLogP0.96
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500105.14
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-cyclopenta[b]pyrrole?
The IUPAC name of 2,3-dihydro-1H-cyclopenta[b]pyrrole (CID 90192716) is 2,3-dihydro-1H-cyclopenta[b]pyrrole.
What is the SMILES notation for 2,3-dihydro-1H-cyclopenta[b]pyrrole?
The canonical SMILES for 2,3-dihydro-1H-cyclopenta[b]pyrrole is C1=CC=C2CCNC=12.
What is the InChIKey of 2,3-dihydro-1H-cyclopenta[b]pyrrole?
The InChIKey is NXBVAMIYYSQGBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N/c1-2-6-4-5-8-7(6)3-1/h1-2,8H,4-5H2.
What are the key properties of 2,3-dihydro-1H-cyclopenta[b]pyrrole?
2,3-dihydro-1H-cyclopenta[b]pyrrole has a molecular weight of 105.14 g/mol, XLogP of 0.96, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-cyclopenta[b]pyrrole is sourced from PubChem (CID 90192716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).