3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-ylphosphane

C7H14NP — CID 23532217

IUPAC3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-ylphosphane
SMILESPN1CCC2CCCC21
InChIInChI=1S/C7H14NP/c9-8-5-4-6-2-1-3-7(6)8/h6-7H,1-5,9H2
InChIKeyOISAOBPBRBSFHI-UHFFFAOYSA-N
MW143.17 g/mol
LogP1.65
Rot. Bonds

About 3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-ylphosphane

3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-ylphosphane (PubChem CID 23532217) has the molecular formula C7H14NP and a molecular weight of 143.17 g/mol. Its IUPAC name is 3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-ylphosphane.

Molecular Properties

Compound Name3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-ylphosphane
PubChem CID23532217
Molecular FormulaC7H14NP
Molecular Weight143.17 g/mol
Exact Mass143.09
IUPAC Name3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-ylphosphane
SMILESPN1CCC2CCCC21
InChIInChI=1S/C7H14NP/c9-8-5-4-6-2-1-3-7(6)8/h6-7H,1-5,9H2
InChIKeyOISAOBPBRBSFHI-UHFFFAOYSA-N
XLogP1.65
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.17
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-ylphosphane?
The IUPAC name of 3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-ylphosphane (CID 23532217) is 3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-ylphosphane.
What is the SMILES notation for 3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-ylphosphane?
The canonical SMILES for 3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-ylphosphane is PN1CCC2CCCC21.
What is the InChIKey of 3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-ylphosphane?
The InChIKey is OISAOBPBRBSFHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14NP/c9-8-5-4-6-2-1-3-7(6)8/h6-7H,1-5,9H2.
What are the key properties of 3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-ylphosphane?
3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-ylphosphane has a molecular weight of 143.17 g/mol, XLogP of 1.65, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-ylphosphane is sourced from PubChem (CID 23532217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).