3-methylidene-5,6-dihydro-4H-cyclopenta[b]pyrrole

C8H9N — CID 59820667

IUPAC3-methylidene-5,6-dihydro-4H-cyclopenta[b]pyrrole
SMILESC=C1C=NC2=C1CCC2
InChIInChI=1S/C8H9N/c1-6-5-9-8-4-2-3-7(6)8/h5H,1-4H2
InChIKeyRCQYQXHAQPDIQN-UHFFFAOYSA-N
MW119.17 g/mol
LogP2.07
Rot. Bonds

About 3-methylidene-5,6-dihydro-4H-cyclopenta[b]pyrrole

3-methylidene-5,6-dihydro-4H-cyclopenta[b]pyrrole (PubChem CID 59820667) has the molecular formula C8H9N and a molecular weight of 119.17 g/mol. Its IUPAC name is 3-methylidene-5,6-dihydro-4H-cyclopenta[b]pyrrole.

Molecular Properties

Compound Name3-methylidene-5,6-dihydro-4H-cyclopenta[b]pyrrole
PubChem CID59820667
Molecular FormulaC8H9N
Molecular Weight119.17 g/mol
Exact Mass119.07
IUPAC Name3-methylidene-5,6-dihydro-4H-cyclopenta[b]pyrrole
SMILESC=C1C=NC2=C1CCC2
InChIInChI=1S/C8H9N/c1-6-5-9-8-4-2-3-7(6)8/h5H,1-4H2
InChIKeyRCQYQXHAQPDIQN-UHFFFAOYSA-N
XLogP2.07
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500119.17
LogP ≤ 52.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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6,7-dihydro-5H-cyclopenta[c]pyridazine-3,4-dione
CID 138059176
1-cyclopentylidene-5-methylidenecyclononane
CID 162212680
2-methyl-6-methylidenecyclohexene-1-thiol
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CID 158449549
2-(2-methylcyclopenten-1-yl)benzenethiol
CID 118335227
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CID 15164275
4-[(1S,2S)-1,2-dimethyl-14-pyridin-4-yl-3,15-dithiatetracyclo[10.3.0.02,6.07,11]pentadeca-4,6,11,13-tetraen-4-yl]pyridine
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CID 22917403
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CID 59114597

Frequently Asked Questions

What is the IUPAC name of 3-methylidene-5,6-dihydro-4H-cyclopenta[b]pyrrole?
The IUPAC name of 3-methylidene-5,6-dihydro-4H-cyclopenta[b]pyrrole (CID 59820667) is 3-methylidene-5,6-dihydro-4H-cyclopenta[b]pyrrole.
What is the SMILES notation for 3-methylidene-5,6-dihydro-4H-cyclopenta[b]pyrrole?
The canonical SMILES for 3-methylidene-5,6-dihydro-4H-cyclopenta[b]pyrrole is C=C1C=NC2=C1CCC2.
What is the InChIKey of 3-methylidene-5,6-dihydro-4H-cyclopenta[b]pyrrole?
The InChIKey is RCQYQXHAQPDIQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N/c1-6-5-9-8-4-2-3-7(6)8/h5H,1-4H2.
What are the key properties of 3-methylidene-5,6-dihydro-4H-cyclopenta[b]pyrrole?
3-methylidene-5,6-dihydro-4H-cyclopenta[b]pyrrole has a molecular weight of 119.17 g/mol, XLogP of 2.07, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylidene-5,6-dihydro-4H-cyclopenta[b]pyrrole is sourced from PubChem (CID 59820667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).